1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[4-(diethylamino)-2-methylphenyl]piperidine-4-carboxamide
Chemical Structure Depiction of
1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[4-(diethylamino)-2-methylphenyl]piperidine-4-carboxamide
1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[4-(diethylamino)-2-methylphenyl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | F184-1362 |
| Compound Name: | 1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[4-(diethylamino)-2-methylphenyl]piperidine-4-carboxamide |
| Molecular Weight: | 535.06 |
| Molecular Formula: | C25 H31 Cl N4 O5 S |
| Smiles: | CCN(CC)c1ccc(c(C)c1)NC(C1CCN(CC1)S(c1cc2c(cc1[Cl])NC(CO2)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1099 |
| logD: | 2.8421 |
| logSw: | -3.4839 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.349 |
| InChI Key: | IUIDKVFEXDDVIN-UHFFFAOYSA-N |