methyl 4-{N-(cyclopentanecarbonyl)-N-[(4-fluorophenyl)methyl]alanyl}-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-{N-(cyclopentanecarbonyl)-N-[(4-fluorophenyl)methyl]alanyl}-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
methyl 4-{N-(cyclopentanecarbonyl)-N-[(4-fluorophenyl)methyl]alanyl}-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
Compound ID: | V020-6807 |
Compound Name: | methyl 4-{N-(cyclopentanecarbonyl)-N-[(4-fluorophenyl)methyl]alanyl}-1,3,5-trimethyl-1H-pyrrole-2-carboxylate |
Molecular Weight: | 442.53 |
Molecular Formula: | C25 H31 F N2 O4 |
Smiles: | CC(C(c1c(C)c(C(=O)OC)n(C)c1C)=O)N(Cc1ccc(cc1)F)C(C1CCCC1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.8161 |
logD: | 3.8161 |
logSw: | -4.2353 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 52.821 |
InChI Key: | JMAHPTWTRGAOLH-KRWDZBQOSA-N |