ethyl 3,5-dimethyl-4-({N-[(4-methylphenyl)methyl]butanamido}methyl)-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 3,5-dimethyl-4-({N-[(4-methylphenyl)methyl]butanamido}methyl)-1H-pyrrole-2-carboxylate
ethyl 3,5-dimethyl-4-({N-[(4-methylphenyl)methyl]butanamido}methyl)-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | G798-0069 |
| Compound Name: | ethyl 3,5-dimethyl-4-({N-[(4-methylphenyl)methyl]butanamido}methyl)-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 370.49 |
| Molecular Formula: | C22 H30 N2 O3 |
| Smiles: | CCCC(N(Cc1ccc(C)cc1)Cc1c(C)c(C(=O)OCC)[nH]c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4004 |
| logD: | 4.4004 |
| logSw: | -4.1493 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.657 |
| InChI Key: | ZRVFULCQXLHRKF-UHFFFAOYSA-N |