ethyl 4-[N-(3-methoxypropyl)-N-(4-methylbenzene-1-sulfonyl)alanyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-[N-(3-methoxypropyl)-N-(4-methylbenzene-1-sulfonyl)alanyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 4-[N-(3-methoxypropyl)-N-(4-methylbenzene-1-sulfonyl)alanyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V025-4987 |
| Compound Name: | ethyl 4-[N-(3-methoxypropyl)-N-(4-methylbenzene-1-sulfonyl)alanyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 464.58 |
| Molecular Formula: | C23 H32 N2 O6 S |
| Smiles: | CCOC(c1c(C)c(C(C(C)N(CCCOC)S(c2ccc(C)cc2)(=O)=O)=O)c(C)[nH]1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5987 |
| logD: | 3.5987 |
| logSw: | -3.9043 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.811 |
| InChI Key: | YCYQFACPJYZRDL-SFHVURJKSA-N |