N-{6-[4-(3-chlorobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-4-methoxybenzamide
Chemical Structure Depiction of
N-{6-[4-(3-chlorobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-4-methoxybenzamide
N-{6-[4-(3-chlorobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-4-methoxybenzamide
Compound characteristics
| Compound ID: | V013-0896 |
| Compound Name: | N-{6-[4-(3-chlorobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-4-methoxybenzamide |
| Molecular Weight: | 464.95 |
| Molecular Formula: | C25 H25 Cl N4 O3 |
| Smiles: | COc1ccc(cc1)C(Nc1ccc(nc1)N1CCCN(CC1)C(c1cccc(c1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5003 |
| logD: | 4.4999 |
| logSw: | -4.6841 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.714 |
| InChI Key: | HTEUNLMQBDYDHK-UHFFFAOYSA-N |