ethyl 4-{[1-methyl-5-(2-methylpropyl)-4-oxo-4,5-dihydro-1H-pyrrolo[3,2-c]pyridine-2-carbonyl]amino}benzoate
Chemical Structure Depiction of
ethyl 4-{[1-methyl-5-(2-methylpropyl)-4-oxo-4,5-dihydro-1H-pyrrolo[3,2-c]pyridine-2-carbonyl]amino}benzoate
ethyl 4-{[1-methyl-5-(2-methylpropyl)-4-oxo-4,5-dihydro-1H-pyrrolo[3,2-c]pyridine-2-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | M058-0772 |
| Compound Name: | ethyl 4-{[1-methyl-5-(2-methylpropyl)-4-oxo-4,5-dihydro-1H-pyrrolo[3,2-c]pyridine-2-carbonyl]amino}benzoate |
| Molecular Weight: | 395.46 |
| Molecular Formula: | C22 H25 N3 O4 |
| Smiles: | CCOC(c1ccc(cc1)NC(c1cc2C(N(CC(C)C)C=Cc2n1C)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8325 |
| logD: | 3.8035 |
| logSw: | -4.0099 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.815 |
| InChI Key: | CBWWMBRHQAMKPD-UHFFFAOYSA-N |