11-ethyl-N-[(3-methylphenyl)methyl]-10-oxo-10,11-dihydropyrido[3,2-b][1,4]benzoxazepine-8-sulfonamide
Chemical Structure Depiction of
11-ethyl-N-[(3-methylphenyl)methyl]-10-oxo-10,11-dihydropyrido[3,2-b][1,4]benzoxazepine-8-sulfonamide
11-ethyl-N-[(3-methylphenyl)methyl]-10-oxo-10,11-dihydropyrido[3,2-b][1,4]benzoxazepine-8-sulfonamide
Compound characteristics
| Compound ID: | P619-0428 |
| Compound Name: | 11-ethyl-N-[(3-methylphenyl)methyl]-10-oxo-10,11-dihydropyrido[3,2-b][1,4]benzoxazepine-8-sulfonamide |
| Molecular Weight: | 423.49 |
| Molecular Formula: | C22 H21 N3 O4 S |
| Smiles: | CCN1C(c2cc(ccc2Oc2cccnc12)S(NCc1cccc(C)c1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1318 |
| logD: | 4.1316 |
| logSw: | -4.3395 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.651 |
| InChI Key: | YTQXTFOQNLMZDP-UHFFFAOYSA-N |