6-[4-(4-bromobenzoyl)-1,4-diazepan-1-yl]-1,3-dimethylpyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
6-[4-(4-bromobenzoyl)-1,4-diazepan-1-yl]-1,3-dimethylpyrimidine-2,4(1H,3H)-dione
6-[4-(4-bromobenzoyl)-1,4-diazepan-1-yl]-1,3-dimethylpyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | L329-0515 |
| Compound Name: | 6-[4-(4-bromobenzoyl)-1,4-diazepan-1-yl]-1,3-dimethylpyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 421.29 |
| Molecular Formula: | C18 H21 Br N4 O3 |
| Smiles: | CN1C(=CC(N(C)C1=O)=O)N1CCCN(CC1)C(c1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 2.037 |
| logD: | 2.037 |
| logSw: | -2.3096 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.511 |
| InChI Key: | JUKXPPWCHIDLKP-UHFFFAOYSA-N |