ethyl 4-[(5-methyl-2,1,3-benzothiadiazole-4-sulfonyl)amino]butanoate
Chemical Structure Depiction of
ethyl 4-[(5-methyl-2,1,3-benzothiadiazole-4-sulfonyl)amino]butanoate
ethyl 4-[(5-methyl-2,1,3-benzothiadiazole-4-sulfonyl)amino]butanoate
Compound characteristics
Compound ID: | 8015-3229 |
Compound Name: | ethyl 4-[(5-methyl-2,1,3-benzothiadiazole-4-sulfonyl)amino]butanoate |
Molecular Weight: | 343.42 |
Molecular Formula: | C13 H17 N3 O4 S2 |
Smiles: | CCOC(CCCNS(c1c(C)ccc2c1nsn2)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.3023 |
logD: | 2.2947 |
logSw: | -2.7635 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 83.221 |
InChI Key: | SPGNCUNYEIQSPX-UHFFFAOYSA-N |