Methyl 2-amino-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophene-3-carboxylate - CAS 350989-44-5
Catalog: |
BB044734 |
Product Name: |
Methyl 2-amino-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophene-3-carboxylate |
CAS: |
350989-44-5 |
Synonyms: |
methyl 2-amino-4-methyl-5-{[(2-methylphenyl)amino]carbonyl}thiophene-3-carboxylate; Methyl 2-amino-4-methyl-5-(o-tolylcarbamoyl)thiophene-3-carboxylate; 2-amino-4-methyl-5-o-tolylcarbamoylthiophene-3-carboxylic acid methyl ester; methyl 2-amino-4-methyl-5-[N-(2-methylphenyl)carbamoyl]thiophene-3-carboxylate |
IUPAC Name: | methyl 2-amino-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophene-3-carboxylate |
Description: | Methyl 2-amino-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophene-3-carboxylate (CAS# 350989-44-5 ) is a useful research chemical. |
Molecular Weight: | 304.36 |
Molecular Formula: | C15H16N2O3S |
Canonical SMILES: | CC1=CC=CC=C1NC(=O)C2=C(C(=C(S2)N)C(=O)OC)C |
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) |
InChI Key: | MMQKQGACCKDHFT-UHFFFAOYSA-N |
Boiling Point: | 421.5±45.0 °C (Predicted) |
Density: | 1.320±0.06 g/cm3 (Predicted) |
Complexity: | 404 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 304.08816355 |
Formal Charge: | 0 |
Heavy Atom Count: | 21 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 304.08816355 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 110 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.6 |
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