ethyl 4-[N-(2-chlorobenzoyl)-N-(cyclopropylmethyl)alanyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-[N-(2-chlorobenzoyl)-N-(cyclopropylmethyl)alanyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 4-[N-(2-chlorobenzoyl)-N-(cyclopropylmethyl)alanyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
Compound ID: | V020-5860 |
Compound Name: | ethyl 4-[N-(2-chlorobenzoyl)-N-(cyclopropylmethyl)alanyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate |
Molecular Weight: | 430.93 |
Molecular Formula: | C23 H27 Cl N2 O4 |
Smiles: | CCOC(c1c(C)c(C(C(C)N(CC2CC2)C(c2ccccc2[Cl])=O)=O)c(C)[nH]1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.1976 |
logD: | 4.1976 |
logSw: | -4.722 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 61.539 |
InChI Key: | NGLFTOYEPVCKQN-HNNXBMFYSA-N |