4-(2-chlorothieno[3,2-d]pyrimidin-4-yl)morpholine - ≥97% , CAS No.16234-15-4

CAS: 16234-15-4 Cat. No.: M629888 Molecular Weight: 255.72 PubChem CID: 20284971

GRADE & PURITY ≥97%

Synonyms

2-Chloro-4-(4-morpholinyl)thieno[3,2-d]pyrimidine | DTXSID40604642 | 2-Chloro-4-morpholin-4-yl-thieno[3,2-d]pyrimidine | 2-Chloro4-morpholin-4-yl-thieno[3,2-d]pyrimidine | MFCD09909656 | AKOS015850425 | FT-0645881 | DS-10733 | SC3461 | 4-{2-chlorothieno[3

Storage

Store at 2-8°C,Protected from light,Argon charged

Shipped In

Wet ice

Specifications

Synonyms

2-Chloro-4-(4-morpholinyl)thieno[3, 2-d]pyrimidine | DTXSID40604642 | 2-Chloro-4-morpholin-4-yl-thieno[3, 2-d]pyrimidine | 2-Chloro4-morpholin-4-yl-thieno[3, 2-d]pyrimidine | MFCD09909656 | AKOS015850425 | FT-0645881 | DS-10733 | SC3461 | 4-{2-chlorothieno[3

Specifications & Purity

≥97%

Storage

Store at 2-8°C, Protected from light, Argon charged

Shipped In

Wet ice

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥97%

Names and Identifiers

• Pubchem Sid: 528756804
• Canonical Smiles: C1COCCN1C2=NC(=NC3=C2SC=C3)Cl
• IUPAC Name: 4-(2-chlorothieno[3,2-d]pyrimidin-4-yl)morpholine
• InChIKey: HKQMXHKNXRNUCF-UHFFFAOYSA-N
• INCHI: 1S/C10H10ClN3OS/c11-10-12-7-1-6-16-8(7)9(13-10)14-2-4-15-5-3-14/h1,6H,2-5H2
• Isomeric SMILES: C1COCCN1C2=NC(=NC3=C2SC=C3)Cl
• Alternate CAS: 16234-15-4
• PubChem CID: 20284971
• Molecular Weight: 255.72

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Class Thienopyrimidines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Thienopyrimidines
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Thienopyrimidines
• Alternative Parents: Dialkylarylamines Aminopyrimidines and derivatives 2-halopyrimidines Morpholines Imidolactams Aryl chlorides Thiophenes Heteroaromatic compounds Oxacyclic compounds Dialkyl ethers Azacyclic compounds Organochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Thienopyrimidine - Dialkylarylamine - Aminopyrimidine - 2-halopyrimidine - Halopyrimidine - Aryl chloride - Aryl halide - Morpholine - Imidolactam - Pyrimidine - Oxazinane - Heteroaromatic compound - Thiophene - Dialkyl ether - Ether - Oxacycle - Azacycle - Organic oxygen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as thienopyrimidines. These are heterocyclic compounds containing a thiophene ring fused to a pyrimidine ring. Thiophene is 5-membered ring consisting of four carbon atoms and one sulfur atom. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Chemical and Physical Properties

• Sensitivity: light sensitive
• Molecular Weight: 255.720 g/mol
• XLogP3: 2.400
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 255.023 Da
• Monoisotopic Mass: 255.023 Da
• Topological Polar Surface Area: 66.500 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 252.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1