2-(3-chloro-4-methylphenyl)-N-[2-(dimethylamino)ethyl]-4-[(3-methylphenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
2-(3-chloro-4-methylphenyl)-N-[2-(dimethylamino)ethyl]-4-[(3-methylphenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
2-(3-chloro-4-methylphenyl)-N-[2-(dimethylamino)ethyl]-4-[(3-methylphenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
Compound ID: | V021-8404 |
Compound Name: | 2-(3-chloro-4-methylphenyl)-N-[2-(dimethylamino)ethyl]-4-[(3-methylphenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
Molecular Weight: | 455.94 |
Molecular Formula: | C23 H26 Cl N5 O3 |
Salt: | not_available |
Smiles: | Cc1cccc(CN2C(C(C(NCCN(C)C)=O)=NN(C2=O)c2ccc(C)c(c2)[Cl])=O)c1 |
Stereo: | ACHIRAL |
logP: | 3.8923 |
logD: | 2.7752 |
logSw: | -4.1343 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 70.637 |
InChI Key: | NIDVTTCKNPSMBG-UHFFFAOYSA-N |