methyl 3-[(1-{2-[(3-methylbutyl)carbamoyl]phenyl}piperidin-4-yl)amino]-3-oxopropanoate
Chemical Structure Depiction of
methyl 3-[(1-{2-[(3-methylbutyl)carbamoyl]phenyl}piperidin-4-yl)amino]-3-oxopropanoate
methyl 3-[(1-{2-[(3-methylbutyl)carbamoyl]phenyl}piperidin-4-yl)amino]-3-oxopropanoate
Compound characteristics
| Compound ID: | V019-0165 |
| Compound Name: | methyl 3-[(1-{2-[(3-methylbutyl)carbamoyl]phenyl}piperidin-4-yl)amino]-3-oxopropanoate |
| Molecular Weight: | 389.49 |
| Molecular Formula: | C21 H31 N3 O4 |
| Smiles: | CC(C)CCNC(c1ccccc1N1CCC(CC1)NC(CC(=O)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3162 |
| logD: | 2.3162 |
| logSw: | -2.8793 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.5 |
| InChI Key: | KDKJXTVOIWXUSW-UHFFFAOYSA-N |