N-(6-{4-[3-(benzyloxy)-2-hydroxypropyl]-1,4-diazepan-1-yl}pyridin-3-yl)-3-(trifluoromethyl)benzamide
Chemical Structure Depiction of
N-(6-{4-[3-(benzyloxy)-2-hydroxypropyl]-1,4-diazepan-1-yl}pyridin-3-yl)-3-(trifluoromethyl)benzamide
N-(6-{4-[3-(benzyloxy)-2-hydroxypropyl]-1,4-diazepan-1-yl}pyridin-3-yl)-3-(trifluoromethyl)benzamide
Compound characteristics
| Compound ID: | V002-7938 |
| Compound Name: | N-(6-{4-[3-(benzyloxy)-2-hydroxypropyl]-1,4-diazepan-1-yl}pyridin-3-yl)-3-(trifluoromethyl)benzamide |
| Molecular Weight: | 528.57 |
| Molecular Formula: | C28 H31 F3 N4 O3 |
| Smiles: | C1CN(CCN(C1)c1ccc(cn1)NC(c1cccc(c1)C(F)(F)F)=O)CC(COCc1ccccc1)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8489 |
| logD: | 4.7351 |
| logSw: | -4.6527 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.308 |
| InChI Key: | TUTZSZXZUUQYQF-VWLOTQADSA-N |