ethyl 4-(4-{[2-(azepan-1-yl)ethyl]carbamoyl}piperidine-1-sulfonyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 4-(4-{[2-(azepan-1-yl)ethyl]carbamoyl}piperidine-1-sulfonyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate
ethyl 4-(4-{[2-(azepan-1-yl)ethyl]carbamoyl}piperidine-1-sulfonyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | G070-0190 |
| Compound Name: | ethyl 4-(4-{[2-(azepan-1-yl)ethyl]carbamoyl}piperidine-1-sulfonyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 482.64 |
| Molecular Formula: | C23 H38 N4 O5 S |
| Smiles: | CCOC(c1c(c(C)[nH]c1C)S(N1CCC(CC1)C(NCCN1CCCCCC1)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8852 |
| logD: | 0.1026 |
| logSw: | -2.3688 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.059 |
| InChI Key: | CRPIIPQTBQFVSD-UHFFFAOYSA-N |