methyl 4-chloro-2-({[1-(3-methylbenzoyl)-2,3-dihydro-1H-indol-6-yl]methyl}carbamamido)benzoate
Chemical Structure Depiction of
methyl 4-chloro-2-({[1-(3-methylbenzoyl)-2,3-dihydro-1H-indol-6-yl]methyl}carbamamido)benzoate
methyl 4-chloro-2-({[1-(3-methylbenzoyl)-2,3-dihydro-1H-indol-6-yl]methyl}carbamamido)benzoate
Compound characteristics
| Compound ID: | L057-1739 |
| Compound Name: | methyl 4-chloro-2-({[1-(3-methylbenzoyl)-2,3-dihydro-1H-indol-6-yl]methyl}carbamamido)benzoate |
| Molecular Weight: | 477.95 |
| Molecular Formula: | C26 H24 Cl N3 O4 |
| Smiles: | Cc1cccc(c1)C(N1CCc2ccc(CNC(Nc3cc(ccc3C(=O)OC)[Cl])=O)cc12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3981 |
| logD: | 4.3432 |
| logSw: | -4.5327 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.018 |
| InChI Key: | YZQZQQNTNAKIBK-UHFFFAOYSA-N |