methyl 4-[(4-methyl-2-propanamido-1,3-benzothiazol-6-yl)carbamamido]benzoate
Chemical Structure Depiction of
methyl 4-[(4-methyl-2-propanamido-1,3-benzothiazol-6-yl)carbamamido]benzoate
methyl 4-[(4-methyl-2-propanamido-1,3-benzothiazol-6-yl)carbamamido]benzoate
Compound characteristics
| Compound ID: | F690-0346 |
| Compound Name: | methyl 4-[(4-methyl-2-propanamido-1,3-benzothiazol-6-yl)carbamamido]benzoate |
| Molecular Weight: | 412.47 |
| Molecular Formula: | C20 H20 N4 O4 S |
| Smiles: | CCC(Nc1nc2c(C)cc(cc2s1)NC(Nc1ccc(cc1)C(=O)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5969 |
| logD: | 4.5967 |
| logSw: | -4.3986 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 87.396 |
| InChI Key: | NBXMQKYJONYGQZ-UHFFFAOYSA-N |