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Cas Database |
| Name |
4(1H)-Quinazolinone,2,3-dihydro-3-(3-methoxyphenyl)-2-thioxo- |
EINECS | N/A |
| CAS No. | 56671-19-3 | Density | 1.4g/cm3 |
| PSA | 79.11000 | LogP | 3.05690 |
| Solubility | N/A | Melting Point |
291～293℃ |
| Formula | C15H12N2O2S | Boiling Point | 464.1°C at 760 mmHg |
| Molecular Weight | 284.338 | Flash Point | 234.5°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
2-Mercapto-3-(3-methoxy-phenyl)-3H-quinazolin-4-one; 4(3H)-quinazolinone, 2-mercapto-3-(3-methoxyphenyl)- |
Article Data | 5 |
4(1H)-Quinazolinone,2,3-dihydro-3-(3-methoxyphenyl)-2-thioxo- Specification
The 4(1H)-Quinazolinone,2,3-dihydro-3-(3-methoxyphenyl)-2-thioxo- has CAS registry number 56671-193. This chemical's molecular formula is C15H12N2O2S and molecular weight is 284.33. What's more, its systematic name is 3-(3-methoxyphenyl)-2-thioxo-2,3-dihydroquinazolin-4(1H)-one.
Physical properties of 24(1H)-Quinazolinone,2,3-dihydro-3-(3-methoxyphenyl)-2-thioxo- are: (1)ACD/LogP: 2.607; (2)ACD/LogD (pH 5.5): 2.26; (3)ACD/LogD (pH 7.4): 0.58; (4)#H bond acceptors: 4; (5)#Freely Rotating Bonds: 2; (6)#H bond donors: 1; (7)Polar Surface Area: 64.87.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C2c1c(cccc1)NC(=S)N2c3cccc(OC)c3
(2)Std. InChI: InChI=1S/C15H12N2O2S/c1-19-11-6-4-5-10(9-11)17-14(18)12-7-2-3-8-13(12)16-15(17)20/h2-9H,1H3,(H,16,20)
(3)Std. InChIKey: MZGPCTQOUIEHPZ-UHFFFAOYSA-N
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