4-chloro-2-methoxy-N-methyl-N-(3-methyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)benzamide
Chemical Structure Depiction of
4-chloro-2-methoxy-N-methyl-N-(3-methyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)benzamide
4-chloro-2-methoxy-N-methyl-N-(3-methyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)benzamide
Compound characteristics
| Compound ID: | S637-3123 |
| Compound Name: | 4-chloro-2-methoxy-N-methyl-N-(3-methyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)benzamide |
| Molecular Weight: | 348.83 |
| Molecular Formula: | C17 H21 Cl N4 O2 |
| Smiles: | Cc1nnc2CCC(CCn12)N(C)C(c1ccc(cc1OC)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9916 |
| logD: | 1.9891 |
| logSw: | -2.99 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.952 |
| InChI Key: | XEUGCLWBSNUWQJ-ZDUSSCGKSA-N |