2-(3-chlorophenyl)-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-chlorophenyl)-N-(cyclopropylmethyl)-4-[(3-methylphenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
2-(3-chlorophenyl)-N-(cyclopropylmethyl)-4-[(3-methylphenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V015-6553 |
| Compound Name: | 2-(3-chlorophenyl)-N-(cyclopropylmethyl)-4-[(3-methylphenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 424.89 |
| Molecular Formula: | C22 H21 Cl N4 O3 |
| Smiles: | Cc1cccc(CN2C(C(C(NCC3CC3)=O)=NN(C2=O)c2cccc(c2)[Cl])=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.2719 |
| logD: | 4.2718 |
| logSw: | -4.4811 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.181 |
| InChI Key: | ONQSCBFMRTVVDJ-UHFFFAOYSA-N |