N-{2-[4-(2-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)piperazin-1-yl]-2-oxoethyl}thiophene-2-carboxamide
Chemical Structure Depiction of
N-{2-[4-(2-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)piperazin-1-yl]-2-oxoethyl}thiophene-2-carboxamide
N-{2-[4-(2-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)piperazin-1-yl]-2-oxoethyl}thiophene-2-carboxamide
Compound characteristics
| Compound ID: | F537-0330 |
| Compound Name: | N-{2-[4-(2-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)piperazin-1-yl]-2-oxoethyl}thiophene-2-carboxamide |
| Molecular Weight: | 492.57 |
| Molecular Formula: | C21 H24 N4 O6 S2 |
| Smiles: | CCC1C(Nc2cc(ccc2O1)S(N1CCN(CC1)C(CNC(c1cccs1)=O)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.5042 |
| logD: | 1.5038 |
| logSw: | -2.6182 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 106.384 |
| InChI Key: | TYOKIHUQVRGNON-MRXNPFEDSA-N |