6-chloro-2-ethyl-4-[4-(3-methyl-1,2-oxazol-5-yl)thiophene-2-sulfonyl]-3,4-dihydro-2H-1,4-benzoxazine
Chemical Structure Depiction of
6-chloro-2-ethyl-4-[4-(3-methyl-1,2-oxazol-5-yl)thiophene-2-sulfonyl]-3,4-dihydro-2H-1,4-benzoxazine
6-chloro-2-ethyl-4-[4-(3-methyl-1,2-oxazol-5-yl)thiophene-2-sulfonyl]-3,4-dihydro-2H-1,4-benzoxazine
Compound characteristics
Compound ID: | L923-0592 |
Compound Name: | 6-chloro-2-ethyl-4-[4-(3-methyl-1,2-oxazol-5-yl)thiophene-2-sulfonyl]-3,4-dihydro-2H-1,4-benzoxazine |
Molecular Weight: | 424.92 |
Molecular Formula: | C18 H17 Cl N2 O4 S2 |
Smiles: | CCC1CN(c2cc(ccc2O1)[Cl])S(c1cc(cs1)c1cc(C)no1)(=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.276 |
logD: | 4.276 |
logSw: | -4.5386 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 60.994 |
InChI Key: | OBPRPEGQCBYTDY-CQSZACIVSA-N |