2-(4-chlorophenyl)-4-[(3-chlorophenyl)methyl]-N-[2-(dimethylamino)ethyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
2-(4-chlorophenyl)-4-[(3-chlorophenyl)methyl]-N-[2-(dimethylamino)ethyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
2-(4-chlorophenyl)-4-[(3-chlorophenyl)methyl]-N-[2-(dimethylamino)ethyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V022-9702 |
| Compound Name: | 2-(4-chlorophenyl)-4-[(3-chlorophenyl)methyl]-N-[2-(dimethylamino)ethyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 462.33 |
| Molecular Formula: | C21 H21 Cl2 N5 O3 |
| Salt: | not_available |
| Smiles: | CN(C)CCNC(C1C(N(Cc2cccc(c2)[Cl])C(N(c2ccc(cc2)[Cl])N=1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2362 |
| logD: | 2.1191 |
| logSw: | -3.6391 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.637 |
| InChI Key: | SMOQMQPMSZLRFQ-UHFFFAOYSA-N |