Home Aminos 2-({2-methyl-6-phenyl-1H,4H-thieno[2,3-d]pyrimidin-4-ylidene}amino)acetic acid

2-({2-methyl-6-phenyl-1H,4H-thieno[2,3-d]pyrimidin-4-ylidene}amino)acetic acid

CAS No.:
1082176-31-5
Catalog Number:
AG01A1AS
Molecular Formula:
C15H13N3O2S
Molecular Weight:
299.3476
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Product Description
Catalog Number:
AG01A1AS
Chemical Name:
2-({2-methyl-6-phenyl-1H,4H-thieno[2,3-d]pyrimidin-4-ylidene}amino)acetic acid
CAS Number:
1082176-31-5
Molecular Formula:
C15H13N3O2S
Molecular Weight:
299.3476
MDL Number:
MFCD22392231
IUPAC Name:
2-[(2-methyl-6-phenylthieno[2,3-d]pyrimidin-4-yl)amino]acetic acid
InChI:
InChI=1S/C15H13N3O2S/c1-9-17-14(16-8-13(19)20)11-7-12(21-15(11)18-9)10-5-3-2-4-6-10/h2-7H,8H2,1H3,(H,19,20)(H,16,17,18)
InChI Key:
WRNJRATXKVCWHK-UHFFFAOYSA-N
SMILES:
OC(=O)CN=c1nc(C)[nH]c2c1cc(s2)c1ccccc1
Properties
Complexity:
376  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
299.073g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
299.348g/mol
Monoisotopic Mass:
299.073g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties