2-(3-chloro-4-methylphenyl)-N-(cyclopropylmethyl)-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-(cyclopropylmethyl)-4-[(3-methylphenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
2-(3-chloro-4-methylphenyl)-N-(cyclopropylmethyl)-4-[(3-methylphenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V021-8416 |
| Compound Name: | 2-(3-chloro-4-methylphenyl)-N-(cyclopropylmethyl)-4-[(3-methylphenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 438.91 |
| Molecular Formula: | C23 H23 Cl N4 O3 |
| Smiles: | Cc1cccc(CN2C(C(C(NCC3CC3)=O)=NN(C2=O)c2ccc(C)c(c2)[Cl])=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.8872 |
| logD: | 4.8872 |
| logSw: | -4.9019 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.181 |
| InChI Key: | WEEVQMJCLNYSJR-UHFFFAOYSA-N |