methyl 4-methyl-2-({[1-(4-methylbenzoyl)-2,3-dihydro-1H-indol-6-yl]methyl}carbamamido)benzoate
Chemical Structure Depiction of
methyl 4-methyl-2-({[1-(4-methylbenzoyl)-2,3-dihydro-1H-indol-6-yl]methyl}carbamamido)benzoate
methyl 4-methyl-2-({[1-(4-methylbenzoyl)-2,3-dihydro-1H-indol-6-yl]methyl}carbamamido)benzoate
Compound characteristics
| Compound ID: | L057-0273 |
| Compound Name: | methyl 4-methyl-2-({[1-(4-methylbenzoyl)-2,3-dihydro-1H-indol-6-yl]methyl}carbamamido)benzoate |
| Molecular Weight: | 457.53 |
| Molecular Formula: | C27 H27 N3 O4 |
| Smiles: | [H]C1Cc2ccc(CNC(Nc3cc(C)ccc3C(=O)OC)=O)cc2N1C(c1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1185 |
| logD: | 4.118 |
| logSw: | -4.1373 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.018 |
| InChI Key: | VXSBYNGRJMYEMO-UHFFFAOYSA-N |