methyl 2-(8-chloro-7,9-dimethyl-4-oxopyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-3(4H)-yl)benzoate
Chemical Structure Depiction of
methyl 2-(8-chloro-7,9-dimethyl-4-oxopyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-3(4H)-yl)benzoate
methyl 2-(8-chloro-7,9-dimethyl-4-oxopyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-3(4H)-yl)benzoate
Compound characteristics
| Compound ID: | D148-0501 |
| Compound Name: | methyl 2-(8-chloro-7,9-dimethyl-4-oxopyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-3(4H)-yl)benzoate |
| Molecular Weight: | 400.84 |
| Molecular Formula: | C18 H13 Cl N4 O3 S |
| Smiles: | Cc1c(c(C)nc2c1c1c(C(N(c3ccccc3C(=O)OC)N=N1)=O)s2)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.5731 |
| logD: | 4.5731 |
| logSw: | -4.8957 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 68.432 |
| InChI Key: | NLFCDYQVINYPGT-UHFFFAOYSA-N |