4-(6-chloro-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-4-oxobutanamide
Chemical Structure Depiction of
4-(6-chloro-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-4-oxobutanamide
4-(6-chloro-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-4-oxobutanamide
Compound characteristics
| Compound ID: | E015-0229 |
| Compound Name: | 4-(6-chloro-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-4-oxobutanamide |
| Molecular Weight: | 501.03 |
| Molecular Formula: | C26 H33 Cl N4 O4 |
| Smiles: | COc1ccc(cc1)N1CCN(CCCNC(CCC(N2CCOc3ccc(cc23)[Cl])=O)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 2.548 |
| logD: | 1.9619 |
| logSw: | -3.4929 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.075 |
| InChI Key: | GBSMJQFLFZCWRI-UHFFFAOYSA-N |