8-bromo-3-tert-butyl-9-(methoxymethyl)-7-methylpyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one
Chemical Structure Depiction of
8-bromo-3-tert-butyl-9-(methoxymethyl)-7-methylpyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one
8-bromo-3-tert-butyl-9-(methoxymethyl)-7-methylpyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one
Compound characteristics
Compound ID: | D148-0472 |
Compound Name: | 8-bromo-3-tert-butyl-9-(methoxymethyl)-7-methylpyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one |
Molecular Weight: | 397.29 |
Molecular Formula: | C15 H17 Br N4 O2 S |
Smiles: | Cc1c(c(COC)c2c3c(C(N(C(C)(C)C)N=N3)=O)sc2n1)[Br] |
Stereo: | ACHIRAL |
logP: | 3.8841 |
logD: | 3.8841 |
logSw: | -4.3374 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 56.949 |
InChI Key: | LSJMXSSALQRWCY-UHFFFAOYSA-N |