2-MERCAPTO-3-PHENYLAMINO-3H-QUINAZOLIN-4-ONE (CAS 5958-14-5) — formula C14H11N3OS, molecular weight 269.32; category organic chemicals.
| CAS Number | 5958-14-5 |
|---|---|
| Molecular Formula | C14H11N3OS |
| Molecular Weight | 269.32 |
| LogP | 3.1 |
| Category | Organic Chemicals |
2-MERCAPTO-3-PHENYLAMINO-3H-QUINAZOLIN-4-ONE is a carbon-based organic compound with CAS registry number 5958-14-5 and molecular formula C14H11N3OS (molecular weight 269.32), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 5958-14-5
Its molecular formula C14H11N3OS comprises 14 C, 11 H, 3 N, 1 O, 1 S atoms.
Also known as: 2-MERCAPTO-3-PHENYLAMINO-3H-QUINAZOLIN-4-ONE · 3-(苯基氨基)-2-硫代-2,3-二氢喹唑啉-4(1H)-酮
Category: organic chemicals
The CAS registry number of 2-MERCAPTO-3-PHENYLAMINO-3H-QUINAZOLIN-4-ONE is 5958-14-5.
Molecular formula C14H11N3OS, molecular weight 269.32.
It is also registered under: 2-MERCAPTO-3-PHENYLAMINO-3H-QUINAZOLIN-4-ONE, 3-(苯基氨基)-2-硫代-2,3-二氢喹唑啉-4(1H)-酮.
Category: Organic Chemicals.
Independent reference data for 2-MERCAPTO-3-PHENYLAMINO-3H-QUINAZOLIN-4-ONE (CAS 5958-14-5), compiled from public chemistry databases.
| CAS 号 | 5958-14-5 |
|---|---|
| PubChem CID | 976533 |
| 分子式 | C14H11N3OS |
| IUPAC 名称 | 3-anilino-2-sulfanylidene-1H-quinazolin-4-one |
| UNII（FDA） | HMS1591I10 |
| Molecular Weight | 269.32 |
|---|---|
| XLogP3 | 3.1 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 269.06228316 |
| Monoisotopic Mass | 269.06228316 |
| Topological Polar Surface Area | 76.5 |
| Heavy Atom Count | 19 |
5958-14-5; 3-anilino-2-mercaptoquinazolin-4(3H)-one; DTXSID00359621; RefChem:276696; DTXCID80310674; 2-Mercapto-3-(phenylamino)quinazolin-4(3H)-one; 2-Mercapto-3-phenylamino-3H-quinazolin-4-one; 3-anilino-2-sulfanylidene-1H-quinazolin-4-one; 3-(phenylamino)-2-sulfanyl-3,4-dihydroquinazolin-4-one; 3-(Phenylamino)-2-thioxo-2,3-dihydroquinazolin-4(1h)-one; 3-(phenylamino)-2-sulfanyl-3-hydroquinazolin-4-one; 3-anilino-2-sulfanyl-quinazolin-4-one; HMS1591I10; FAA95814; MFCD04217094; SBB022153
3-(苯基氨基)-2-硫代-2,3-二氢喹唑啉-4(1H)-酮 · CAS 5958-14-5 · C14H11N3OS. UNII HMS1591I10.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.