1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-ethyl-N-phenylprolinamide
Chemical Structure Depiction of
1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-ethyl-N-phenylprolinamide
1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-ethyl-N-phenylprolinamide
Compound characteristics
| Compound ID: | F632-1231 |
| Compound Name: | 1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-ethyl-N-phenylprolinamide |
| Molecular Weight: | 463.94 |
| Molecular Formula: | C21 H22 Cl N3 O5 S |
| Smiles: | CCN(C(C1CCCN1S(c1cc2c(cc1[Cl])NC(CO2)=O)(=O)=O)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2749 |
| logD: | 2.2163 |
| logSw: | -3.3167 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.404 |
| InChI Key: | MQZPMXWKOXVAPN-KRWDZBQOSA-N |