Home Halogens ({4-chloro-5,6-dimethylthieno[2,3-d]pyrimidin-2-yl}methyl)diethylamine

({4-chloro-5,6-dimethylthieno[2,3-d]pyrimidin-2-yl}methyl)diethylamine

CAS No.:
793727-93-2
Catalog Number:
AG00ID1C
Molecular Formula:
C13H18ClN3S
Molecular Weight:
283.8201
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Product Description
Catalog Number:
AG00ID1C
Chemical Name:
({4-chloro-5,6-dimethylthieno[2,3-d]pyrimidin-2-yl}methyl)diethylamine
CAS Number:
793727-93-2
Molecular Formula:
C13H18ClN3S
Molecular Weight:
283.8201
MDL Number:
MFCD06364997
IUPAC Name:
N-[(4-chloro-5,6-dimethylthieno[2,3-d]pyrimidin-2-yl)methyl]-N-ethylethanamine
InChI:
InChI=1S/C13H18ClN3S/c1-5-17(6-2)7-10-15-12(14)11-8(3)9(4)18-13(11)16-10/h5-7H2,1-4H3
InChI Key:
FLEUSBXGTSLJKH-UHFFFAOYSA-N
SMILES:
CCN(Cc1nc(Cl)c2c(n1)sc(c2C)C)CC
Properties
Complexity:
275  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.091g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
283.818g/mol
Monoisotopic Mass:
283.091g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
57.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  
Properties