ethyl 3-{[1,5-dimethyl-4-(4-methylpiperidine-1-sulfonyl)-1H-pyrrole-2-carbonyl]amino}benzoate
Chemical Structure Depiction of
ethyl 3-{[1,5-dimethyl-4-(4-methylpiperidine-1-sulfonyl)-1H-pyrrole-2-carbonyl]amino}benzoate
ethyl 3-{[1,5-dimethyl-4-(4-methylpiperidine-1-sulfonyl)-1H-pyrrole-2-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | F638-3039 |
| Compound Name: | ethyl 3-{[1,5-dimethyl-4-(4-methylpiperidine-1-sulfonyl)-1H-pyrrole-2-carbonyl]amino}benzoate |
| Molecular Weight: | 447.55 |
| Molecular Formula: | C22 H29 N3 O5 S |
| Smiles: | CCOC(c1cccc(c1)NC(c1cc(c(C)n1C)S(N1CCC(C)CC1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7423 |
| logD: | 3.7417 |
| logSw: | -3.915 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.827 |
| InChI Key: | VCTRAMYNCDNJHO-UHFFFAOYSA-N |