N-[(1-methyl-1H-pyrrol-2-yl)methyl]-1,4,5,6,7,8-hexahydrocyclohepta[c]pyrazole-3-carboxamide
Chemical Structure Depiction of
N-[(1-methyl-1H-pyrrol-2-yl)methyl]-1,4,5,6,7,8-hexahydrocyclohepta[c]pyrazole-3-carboxamide
N-[(1-methyl-1H-pyrrol-2-yl)methyl]-1,4,5,6,7,8-hexahydrocyclohepta[c]pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | IB06-7135 |
| Compound Name: | N-[(1-methyl-1H-pyrrol-2-yl)methyl]-1,4,5,6,7,8-hexahydrocyclohepta[c]pyrazole-3-carboxamide |
| Molecular Weight: | 272.35 |
| Molecular Formula: | C15 H20 N4 O |
| Smiles: | Cn1cccc1CNC(c1c2CCCCCc2[nH]n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.39 |
| logD: | 2.39 |
| logSw: | -3.09 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.1 |
| InChI Key: | YTEAJZHVYIKRIR-UHFFFAOYSA-N |