1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-cyclooctylprolinamide
Chemical Structure Depiction of
1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-cyclooctylprolinamide
1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-cyclooctylprolinamide
Compound characteristics
| Compound ID: | F632-1220 |
| Compound Name: | 1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-cyclooctylprolinamide |
| Molecular Weight: | 469.99 |
| Molecular Formula: | C21 H28 Cl N3 O5 S |
| Smiles: | C1CCCC(CCC1)NC(C1CCCN1S(c1cc2c(cc1[Cl])NC(CO2)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0546 |
| logD: | 2.996 |
| logSw: | -3.5636 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.526 |
| InChI Key: | DBDDZBSSXQXGAU-KRWDZBQOSA-N |