1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[4-(propan-2-yl)phenyl]piperidine-4-carboxamide
Chemical Structure Depiction of
1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[4-(propan-2-yl)phenyl]piperidine-4-carboxamide
1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[4-(propan-2-yl)phenyl]piperidine-4-carboxamide
Compound characteristics
Compound ID: | F184-1315 |
Compound Name: | 1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[4-(propan-2-yl)phenyl]piperidine-4-carboxamide |
Molecular Weight: | 491.99 |
Molecular Formula: | C23 H26 Cl N3 O5 S |
Smiles: | CC(C)c1ccc(cc1)NC(C1CCN(CC1)S(c1cc2c(cc1[Cl])NC(CO2)=O)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.3724 |
logD: | 3.3138 |
logSw: | -3.878 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 88.311 |
InChI Key: | YKEQSPKIDIAJBZ-UHFFFAOYSA-N |