6-[4-(5-methylthiophene-2-carbonyl)piperazine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
6-[4-(5-methylthiophene-2-carbonyl)piperazine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
6-[4-(5-methylthiophene-2-carbonyl)piperazine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F537-0112 |
| Compound Name: | 6-[4-(5-methylthiophene-2-carbonyl)piperazine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 421.49 |
| Molecular Formula: | C18 H19 N3 O5 S2 |
| Smiles: | Cc1ccc(C(N2CCN(CC2)S(c2ccc3c(c2)NC(CO3)=O)(=O)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 1.7799 |
| logD: | 1.7797 |
| logSw: | -2.7716 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.694 |
| InChI Key: | MMFJEBXFDREYDP-UHFFFAOYSA-N |