2-ethyl-6-[4-(thiophene-2-carbonyl)piperazine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
2-ethyl-6-[4-(thiophene-2-carbonyl)piperazine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
2-ethyl-6-[4-(thiophene-2-carbonyl)piperazine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
Compound ID: | F537-0362 |
Compound Name: | 2-ethyl-6-[4-(thiophene-2-carbonyl)piperazine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one |
Molecular Weight: | 435.52 |
Molecular Formula: | C19 H21 N3 O5 S2 |
Smiles: | CCC1C(Nc2cc(ccc2O1)S(N1CCN(CC1)C(c1cccs1)=O)(=O)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.3011 |
logD: | 2.3007 |
logSw: | -3.0463 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 82.227 |
InChI Key: | IZHGHYZGVXMYNO-OAHLLOKOSA-N |