methyl 2-{[4-(1,3-benzothiazol-2-yl)-2-methylphenyl]carbamamido}-4-methylbenzoate
Chemical Structure Depiction of
methyl 2-{[4-(1,3-benzothiazol-2-yl)-2-methylphenyl]carbamamido}-4-methylbenzoate
methyl 2-{[4-(1,3-benzothiazol-2-yl)-2-methylphenyl]carbamamido}-4-methylbenzoate
Compound characteristics
| Compound ID: | L320-0480 |
| Compound Name: | methyl 2-{[4-(1,3-benzothiazol-2-yl)-2-methylphenyl]carbamamido}-4-methylbenzoate |
| Molecular Weight: | 431.51 |
| Molecular Formula: | C24 H21 N3 O3 S |
| Smiles: | Cc1ccc(C(=O)OC)c(c1)NC(Nc1ccc(cc1C)c1nc2ccccc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4791 |
| logD: | 5.4744 |
| logSw: | -5.4734 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.769 |
| InChI Key: | NTXBJJOUWSRESK-UHFFFAOYSA-N |