methyl 4-(4-methylpiperazin-1-yl)-3-[(1-phenylcyclopentane-1-carbonyl)amino]benzoate
Chemical Structure Depiction of
methyl 4-(4-methylpiperazin-1-yl)-3-[(1-phenylcyclopentane-1-carbonyl)amino]benzoate
methyl 4-(4-methylpiperazin-1-yl)-3-[(1-phenylcyclopentane-1-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | J029-0977 |
| Compound Name: | methyl 4-(4-methylpiperazin-1-yl)-3-[(1-phenylcyclopentane-1-carbonyl)amino]benzoate |
| Molecular Weight: | 421.54 |
| Molecular Formula: | C25 H31 N3 O3 |
| Smiles: | CN1CCN(CC1)c1ccc(cc1NC(C1(CCCC1)c1ccccc1)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.4048 |
| logD: | 3.9299 |
| logSw: | -4.2672 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.72 |
| InChI Key: | GDQVZFSKBCRDKE-UHFFFAOYSA-N |