1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-ethyl-N-(4-methoxyphenyl)piperidine-4-carboxamide
Chemical Structure Depiction of
1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-ethyl-N-(4-methoxyphenyl)piperidine-4-carboxamide
1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-ethyl-N-(4-methoxyphenyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | F184-1444 |
| Compound Name: | 1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-ethyl-N-(4-methoxyphenyl)piperidine-4-carboxamide |
| Molecular Weight: | 507.99 |
| Molecular Formula: | C23 H26 Cl N3 O6 S |
| Smiles: | CCN(C(C1CCN(CC1)S(c1cc2c(cc1[Cl])NC(CO2)=O)(=O)=O)=O)c1ccc(cc1)OC |
| Stereo: | ACHIRAL |
| logP: | 2.7609 |
| logD: | 2.7023 |
| logSw: | -3.5481 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.111 |
| InChI Key: | IJDKHLJTGNYQQS-UHFFFAOYSA-N |