4-(6-chloro-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxobutanamide
Chemical Structure Depiction of
4-(6-chloro-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxobutanamide
4-(6-chloro-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxobutanamide
Compound characteristics
| Compound ID: | E015-0102 |
| Compound Name: | 4-(6-chloro-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxobutanamide |
| Molecular Weight: | 432.9 |
| Molecular Formula: | C22 H25 Cl N2 O5 |
| Smiles: | COc1ccc(CCNC(CCC(N2CCOc3ccc(cc23)[Cl])=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 1.9686 |
| logD: | 1.9686 |
| logSw: | -2.9798 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.549 |
| InChI Key: | HQOCSBVOIBOPBE-UHFFFAOYSA-N |