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methyl 2-amino-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophene-3-carboxylate

methyl 2-amino-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophene-3-carboxylate

CAS: 350989-44-5

Formula: C15H16N2O3S

SMILES: COC(=O)C1=C(N)SC(C(=O)NC2=C(C)C=CC=C2)=C1C

IUPAC: methyl 2-amino-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophene-3-carboxylate

InChI: InChI=1S/C15H16N2O3S/c1-8-6-4-5-7-10(8)17-14(18)12-9(2)11(13(16)21-12)15(19)20-3/h4-7H,16H2,1-3H3,(H,17,18)

Composition: C (59.19%), H (5.30%), N (9.20%), O (15.77%), S (10.53%)

Molar Mass: 304.36

Atom Count: 37

Heavy Atom Count: 21

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 304.088163557
Formal Charge 0
FSP3 0.2
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey MMQKQGACCKDHFT-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 84.45
Topological Polar Surface Area 81.42
Polarizability 30.74
Ring Count 2
Rotatable Bond Count 4

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95% <2 Days 350989-44-5 $134.76$134.76
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