methyl 1-ethyl-4-[N-(4-fluorobenzoyl)-N-(prop-2-en-1-yl)alanyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 1-ethyl-4-[N-(4-fluorobenzoyl)-N-(prop-2-en-1-yl)alanyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
methyl 1-ethyl-4-[N-(4-fluorobenzoyl)-N-(prop-2-en-1-yl)alanyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V024-6573 |
| Compound Name: | methyl 1-ethyl-4-[N-(4-fluorobenzoyl)-N-(prop-2-en-1-yl)alanyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 414.48 |
| Molecular Formula: | C23 H27 F N2 O4 |
| Smiles: | CCn1c(C)c(C(C(C)N(CC=C)C(c2ccc(cc2)F)=O)=O)c(C)c1C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6362 |
| logD: | 3.6362 |
| logSw: | -4.1107 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.427 |
| InChI Key: | IHYZZWMHTOCOIG-INIZCTEOSA-N |