1-(6-chloro-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-[4-(4-methoxyphenyl)piperazin-1-yl]butane-1,4-dione
Chemical Structure Depiction of
1-(6-chloro-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-[4-(4-methoxyphenyl)piperazin-1-yl]butane-1,4-dione
1-(6-chloro-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-[4-(4-methoxyphenyl)piperazin-1-yl]butane-1,4-dione
Compound characteristics
| Compound ID: | E015-0048 |
| Compound Name: | 1-(6-chloro-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-4-[4-(4-methoxyphenyl)piperazin-1-yl]butane-1,4-dione |
| Molecular Weight: | 443.93 |
| Molecular Formula: | C23 H26 Cl N3 O4 |
| Smiles: | COc1ccc(cc1)N1CCN(CC1)C(CCC(N1CCOc2ccc(cc12)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0088 |
| logD: | 3.0085 |
| logSw: | -3.4391 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.172 |
| InChI Key: | VTWSTBLCTKVCFH-UHFFFAOYSA-N |