In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 19 | No |
Popular Name: 3-(4-fluorophenyl)-2-thioxo-2,3-dihydro-4(1H)-quinazolinone 3-(4-fluorophenyl)-2-thioxo-2,3-…
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CAS Numbers: , 1547-15-5 , [1547-15-5]
2,3-Dihydro-3-(4-fluorophenyl)-2-thioxo-1H-quinazolin-4-one
2,3-Dihydro-3-(4-fluorophenyl)-2-thioxoquinazolin-4(1H)-one
3-(4-Fluoro-phenyl)-2-mercapto-3H-quinazolin-4-one
3-(4-Fluoro-phenyl)-2-thioxo-2,3-dihydro-1h-quinazolin-4-one
3-(4-fluorophenyl)-2-mercaptoquinazolin-4(3H)-one
3-(4-fluorophenyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one
3-(4-fluorophenyl)-2-sulfanyl-4(3H)-quinazolinone,80<90%
3-(4-fluorophenyl)-2-thioxo-2,3-dihydroquinazolin-4(1H)-one
3-(4-Fluorophenyl)-4-oxo-1,2,3,4-tetrahydro-2-thioxoquinazoline
4(3H)-quinazolinone, 3-(4-fluorophenyl)-2-mercapto-
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 2.48 | 8.67 | -13.72 | 1 | 3 | 0 | 38 | 272.304 | 1 | ↓ |
Mid Mid (pH 6-8) | 3.20 | 8.24 | -40.01 | 0 | 3 | -1 | 35 | 271.296 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
mp | 156 - 158 | MolMall (formerly Molecular Diversity Preservation International) |
MP | 334 - 336 | Enamine Building Blocks |
MP | 334...336 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
MP | >250° | Matrix Scientific |
Purity | >95% | Matrix Scientific |
Warnings | IRRITANT | Matrix Scientific |