6-{4-[(4-chlorophenoxy)acetyl]-1,4-diazepan-1-yl}-1,3-di(propan-2-yl)pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
6-{4-[(4-chlorophenoxy)acetyl]-1,4-diazepan-1-yl}-1,3-di(propan-2-yl)pyrimidine-2,4(1H,3H)-dione
6-{4-[(4-chlorophenoxy)acetyl]-1,4-diazepan-1-yl}-1,3-di(propan-2-yl)pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | L329-0819 |
| Compound Name: | 6-{4-[(4-chlorophenoxy)acetyl]-1,4-diazepan-1-yl}-1,3-di(propan-2-yl)pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 462.98 |
| Molecular Formula: | C23 H31 Cl N4 O4 |
| Smiles: | CC(C)N1C(=CC(N(C(C)C)C1=O)=O)N1CCCN(CC1)C(COc1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.9679 |
| logD: | 2.9679 |
| logSw: | -3.4385 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.393 |
| InChI Key: | IENDTRNHUCCQGH-UHFFFAOYSA-N |