4-(6-chloro-2-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-[2-(3,4-diethoxyphenyl)ethyl]-4-oxobutanamide
Chemical Structure Depiction of
4-(6-chloro-2-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-[2-(3,4-diethoxyphenyl)ethyl]-4-oxobutanamide
4-(6-chloro-2-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-[2-(3,4-diethoxyphenyl)ethyl]-4-oxobutanamide
Compound characteristics
| Compound ID: | E015-0514 |
| Compound Name: | 4-(6-chloro-2-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-[2-(3,4-diethoxyphenyl)ethyl]-4-oxobutanamide |
| Molecular Weight: | 474.98 |
| Molecular Formula: | C25 H31 Cl N2 O5 |
| Smiles: | CCOc1ccc(CCNC(CCC(N2CC(C)Oc3ccc(cc23)[Cl])=O)=O)cc1OCC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8583 |
| logD: | 2.8583 |
| logSw: | -3.522 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.806 |
| InChI Key: | VAJAITVKLBPVTP-QGZVFWFLSA-N |