N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(2,4,5,6-tetrahydrobenzo[6,7]cyclohepta[1,2-c]pyrazol-3-yl)benzamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(2,4,5,6-tetrahydrobenzo[6,7]cyclohepta[1,2-c]pyrazol-3-yl)benzamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(2,4,5,6-tetrahydrobenzo[6,7]cyclohepta[1,2-c]pyrazol-3-yl)benzamide
Compound characteristics
| Compound ID: | V010-5338 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(2,4,5,6-tetrahydrobenzo[6,7]cyclohepta[1,2-c]pyrazol-3-yl)benzamide |
| Molecular Weight: | 467.57 |
| Molecular Formula: | C29 H29 N3 O3 |
| Salt: | not_available |
| Smiles: | COc1ccc(CCNC(c2ccc(cc2)c2c3CCCc4ccccc4c3n[nH]2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.7092 |
| logD: | 4.7092 |
| logSw: | -4.5154 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.856 |
| InChI Key: | WQSADVATFXNRPN-UHFFFAOYSA-N |