2-Thioxo-3-(3-(trifluoromethyl)phenyl)-2,3-dihydro-4(1H)-quinazolinone (CAS 81066-86-6) — formula C15H9F3N2OS, molecular weight 322.31; category organic chemicals.
| CAS Number | 81066-86-6 |
|---|---|
| Molecular Formula | C15H9F3N2OS |
| Molecular Weight | 322.31 |
| LogP | 3.7 |
| Category | Organic Chemicals |
2-Thioxo-3-(3-(trifluoromethyl)phenyl)-2,3-dihydro-4(1H)-quinazolinone is a carbon-based organic compound with CAS registry number 81066-86-6 and molecular formula C15H9F3N2OS (molecular weight 322.31), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 81066-86-6
Its molecular formula C15H9F3N2OS comprises 15 C, 9 H, 3 F, 2 N, 1 O, 1 S atoms.
Also known as: 2-Thioxo-3-(3-(trifluoromethyl)phenyl)-2,3-dihydro-4(1H)-quinazolinone · 2-硫代-3-(3-(三氟甲基)苯基)-2,3-二氢-4(1H)-喹唑啉酮
Category: organic chemicals
The CAS registry number of 2-Thioxo-3-(3-(trifluoromethyl)phenyl)-2,3-dihydro-4(1H)-quinazolinone is 81066-86-6.
Molecular formula C15H9F3N2OS, molecular weight 322.31.
It is also registered under: 2-Thioxo-3-(3-(trifluoromethyl)phenyl)-2,3-dihydro-4(1H)-quinazolinone, 2-硫代-3-(3-(三氟甲基)苯基)-2,3-二氢-4(1H)-喹唑啉酮.
Category: Organic Chemicals.
Independent reference data for 2-Thioxo-3-(3-(trifluoromethyl)phenyl)-2,3-dihydro-4(1H)-quinazolinone (CAS 81066-86-6), compiled from public chemistry databases.
| CAS 号 | 81066-86-6 |
|---|---|
| PubChem CID | 805279 |
| 分子式 | C15H9F3N2OS |
| IUPAC 名称 | 2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1H-quinazolin-4-one |
| UNII（FDA） | 4W4SU00GX3 |
| Molecular Weight | 322.31 |
|---|---|
| XLogP3 | 3.7 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 1 |
| Exact Mass | 322.03876857 |
| Monoisotopic Mass | 322.03876857 |
| Topological Polar Surface Area | 64.4 |
| Heavy Atom Count | 22 |
81066-86-6; 2-mercapto-3-[3-(trifluoromethyl)phenyl]quinazolin-4(3H)-one; 2-Thioxo-3-(3-(trifluoromethyl)phenyl)-2,3-dihydro-4(1H)-quinazolinone; 4W4SU00GX3; NSC209934; NSC 209934; 2-sulfanyl-3-[3-(trifluoromethyl)phenyl]-3,4-dihydroquinazolin-4-one; UNII-4W4SU00GX3; MLS003107244; 4(3h)-quinazolinone, 2-mercapto-3-[3-(trifluoromethyl)phenyl]-; NSC-209934; 2-Thioxo-3-(3-(trifluoromethyl)phenyl)-2,3-dihydroquinazolin-4(1h)-one; 2-Mercapto-3-(3-(trifluoromethyl)phenyl)quinazolin-4(3H)-one; 4(1H)-Quinazolinone,2,3-dihydro-2-thioxo-3-[3-(trifluoromethyl)phenyl]-; 2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1H-quinazolin-4-one; 2-thioxo-3-[3-(trifluoromethyl)phenyl]-2,3-dihydroquinazolin-4(1H)-one
2-硫代-3-(3-(三氟甲基)苯基)-2,3-二氢-4(1H)-喹唑啉酮 · CAS 81066-86-6 · C15H9F3N2OS. UNII 4W4SU00GX3.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.