methyl (2-{4,5-dimethoxy-2-[(4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)amino]phenyl}ethyl)carbamate
Chemical Structure Depiction of
methyl (2-{4,5-dimethoxy-2-[(4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)amino]phenyl}ethyl)carbamate
methyl (2-{4,5-dimethoxy-2-[(4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)amino]phenyl}ethyl)carbamate
Compound characteristics
| Compound ID: | 8018-8260 |
| Compound Name: | methyl (2-{4,5-dimethoxy-2-[(4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)amino]phenyl}ethyl)carbamate |
| Molecular Weight: | 479.51 |
| Molecular Formula: | C21 H25 N3 O8 S |
| Smiles: | CN1C(COc2ccc(cc12)S(Nc1cc(c(cc1CCNC(=O)OC)OC)OC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1589 |
| logD: | 1.129 |
| logSw: | -2.4936 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 112.346 |
| InChI Key: | PCIXUBNOXBNGJJ-UHFFFAOYSA-N |