methyl 1-ethyl-4-{N-(4-methoxybenzene-1-sulfonyl)-N-[2-(morpholin-4-yl)ethyl]glycyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 1-ethyl-4-{N-(4-methoxybenzene-1-sulfonyl)-N-[2-(morpholin-4-yl)ethyl]glycyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
methyl 1-ethyl-4-{N-(4-methoxybenzene-1-sulfonyl)-N-[2-(morpholin-4-yl)ethyl]glycyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V030-5570 |
| Compound Name: | methyl 1-ethyl-4-{N-(4-methoxybenzene-1-sulfonyl)-N-[2-(morpholin-4-yl)ethyl]glycyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 521.63 |
| Molecular Formula: | C25 H35 N3 O7 S |
| Salt: | not_available |
| Smiles: | CCn1c(C)c(C(CN(CCN2CCOCC2)S(c2ccc(cc2)OC)(=O)=O)=O)c(C)c1C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.2235 |
| logD: | 2.2177 |
| logSw: | -2.5653 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 85.899 |
| InChI Key: | XBRHQNJCHXCFGO-UHFFFAOYSA-N |