N-{1-[4-(cyclopropanecarbonyl)-3-methylpiperazin-1-yl]-3-(1H-indol-3-yl)-1-oxopropan-2-yl}-4-nitrobenzamide
Chemical Structure Depiction of
N-{1-[4-(cyclopropanecarbonyl)-3-methylpiperazin-1-yl]-3-(1H-indol-3-yl)-1-oxopropan-2-yl}-4-nitrobenzamide
N-{1-[4-(cyclopropanecarbonyl)-3-methylpiperazin-1-yl]-3-(1H-indol-3-yl)-1-oxopropan-2-yl}-4-nitrobenzamide
Compound characteristics
| Compound ID: | V009-1727 |
| Compound Name: | N-{1-[4-(cyclopropanecarbonyl)-3-methylpiperazin-1-yl]-3-(1H-indol-3-yl)-1-oxopropan-2-yl}-4-nitrobenzamide |
| Molecular Weight: | 503.56 |
| Molecular Formula: | C27 H29 N5 O5 |
| Smiles: | CC1CN(CCN1C(C1CC1)=O)C(C(Cc1c[nH]c2ccccc12)NC(c1ccc(cc1)[N+]([O-])=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.1086 |
| logD: | 3.1084 |
| logSw: | -3.2923 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 100.381 |
| InChI Key: | MJHVLZFVVJMVRP-UHFFFAOYSA-N |