methyl 2-{[5-(2-methylpiperidin-1-yl)-1,3,4-thiadiazol-2-yl]carbamamido}benzoate
Chemical Structure Depiction of
methyl 2-{[5-(2-methylpiperidin-1-yl)-1,3,4-thiadiazol-2-yl]carbamamido}benzoate
methyl 2-{[5-(2-methylpiperidin-1-yl)-1,3,4-thiadiazol-2-yl]carbamamido}benzoate
Compound characteristics
Compound ID: | E002-0154 |
Compound Name: | methyl 2-{[5-(2-methylpiperidin-1-yl)-1,3,4-thiadiazol-2-yl]carbamamido}benzoate |
Molecular Weight: | 375.45 |
Molecular Formula: | C17 H21 N5 O3 S |
Smiles: | CC1CCCCN1c1nnc(NC(Nc2ccccc2C(=O)OC)=O)s1 |
Stereo: | RACEMIC MIXTURE |
logP: | 3.6633 |
logD: | 3.6617 |
logSw: | -3.9583 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 79.115 |
InChI Key: | YGKDZKGXBVIQJG-NSHDSACASA-N |