4-[(7-bromo-5-nitro-2,1,3-benzothiadiazol-4-yl)sulfanyl]quinazoline
Chemical Structure Depiction of
4-[(7-bromo-5-nitro-2,1,3-benzothiadiazol-4-yl)sulfanyl]quinazoline
4-[(7-bromo-5-nitro-2,1,3-benzothiadiazol-4-yl)sulfanyl]quinazoline
Compound characteristics
Compound ID: | 8012-2046 |
Compound Name: | 4-[(7-bromo-5-nitro-2,1,3-benzothiadiazol-4-yl)sulfanyl]quinazoline |
Molecular Weight: | 420.26 |
Molecular Formula: | C14 H6 Br N5 O2 S2 |
Smiles: | c1ccc2c(c1)c(ncn2)Sc1c(cc(c2c1nsn2)[Br])[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 4.357 |
logD: | 4.357 |
logSw: | -4.6205 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 74.427 |
InChI Key: | PABZOTXEXSHDNV-UHFFFAOYSA-N |