N-{6-[4-(3-bromobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}furan-2-carboxamide
Chemical Structure Depiction of
N-{6-[4-(3-bromobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}furan-2-carboxamide
N-{6-[4-(3-bromobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}furan-2-carboxamide
Compound characteristics
| Compound ID: | V013-6842 |
| Compound Name: | N-{6-[4-(3-bromobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}furan-2-carboxamide |
| Molecular Weight: | 469.34 |
| Molecular Formula: | C22 H21 Br N4 O3 |
| Smiles: | C1CN(CCN(C1)c1ccc(cn1)NC(c1ccco1)=O)C(c1cccc(c1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.9765 |
| logD: | 3.976 |
| logSw: | -3.9592 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.749 |
| InChI Key: | KOWFCIIZHWFZMI-UHFFFAOYSA-N |