5-(6-chloro-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}thiophene-2-carboxamide
Chemical Structure Depiction of
5-(6-chloro-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}thiophene-2-carboxamide
5-(6-chloro-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}thiophene-2-carboxamide
Compound characteristics
| Compound ID: | G278-1168 |
| Compound Name: | 5-(6-chloro-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}thiophene-2-carboxamide |
| Molecular Weight: | 430.97 |
| Molecular Formula: | C21 H19 Cl N2 O2 S2 |
| Smiles: | CSc1ccc(CNC(c2ccc(N3CCOc4ccc(cc34)[Cl])s2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.7209 |
| logD: | 5.7209 |
| logSw: | -5.852 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.09 |
| InChI Key: | YXEJCOXQAXALDD-UHFFFAOYSA-N |