9-methyl-2-(pyridin-3-yl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Chemical Structure Depiction of
9-methyl-2-(pyridin-3-yl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
9-methyl-2-(pyridin-3-yl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Compound characteristics
Compound ID: | C766-0597 |
Compound Name: | 9-methyl-2-(pyridin-3-yl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione |
Molecular Weight: | 307.37 |
Molecular Formula: | C17 H13 N3 O S |
Smiles: | Cc1cccc2CC3=C(N=C(c4cccnc4)NC3=S)Oc12 |
Stereo: | ACHIRAL |
logP: | 3.0998 |
logD: | 3.0998 |
logSw: | -3.0199 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 38.837 |
InChI Key: | GPCMXJWGJPXASZ-UHFFFAOYSA-N |