methyl 4-{[4-(4-methylphenyl)-3-(1H-pyrrol-1-yl)thiophene-2-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 4-{[4-(4-methylphenyl)-3-(1H-pyrrol-1-yl)thiophene-2-carbonyl]amino}benzoate
methyl 4-{[4-(4-methylphenyl)-3-(1H-pyrrol-1-yl)thiophene-2-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | F423-0258 |
| Compound Name: | methyl 4-{[4-(4-methylphenyl)-3-(1H-pyrrol-1-yl)thiophene-2-carbonyl]amino}benzoate |
| Molecular Weight: | 416.5 |
| Molecular Formula: | C24 H20 N2 O3 S |
| Smiles: | Cc1ccc(cc1)c1csc(C(Nc2ccc(cc2)C(=O)OC)=O)c1n1cccc1 |
| Stereo: | ACHIRAL |
| logP: | 6.0485 |
| logD: | 6.0485 |
| logSw: | -5.5749 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.634 |
| InChI Key: | BGELRLADNWWMOK-UHFFFAOYSA-N |