3-(1H-IMIDAZOL-4-YL)-2-{[(4-METHYLPHENYL)SULFONYL]AMINO}PROPANOIC ACID (CAS 21013-92-3) — formula C13H15N3O4S, molecular weight 309.34; category organic chemicals.
| CAS Number | 21013-92-3 |
|---|---|
| Molecular Formula | C13H15N3O4S |
| Molecular Weight | 309.34 |
| LogP | 1 |
| Category | Organic Chemicals |
3-(1H-IMIDAZOL-4-YL)-2-{[(4-METHYLPHENYL)SULFONYL]AMINO}PROPANOIC ACID is a carbon-based organic compound with CAS registry number 21013-92-3 and molecular formula C13H15N3O4S (molecular weight 309.34), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 21013-92-3
Its molecular formula C13H15N3O4S comprises 13 C, 15 H, 3 N, 4 O, 1 S atoms.
Also known as: 3-(1H-IMIDAZOL-4-YL)-2-{[(4-METHYLPHENYL)SULFONYL]AMINO}PROPANOIC ACID · 3-(1H-咪唑-4-YL)-2-{[(4-甲基苯基)磺酰]氨基}丙酸
Category: organic chemicals
The CAS registry number of 3-(1H-IMIDAZOL-4-YL)-2-{[(4-METHYLPHENYL)SULFONYL]AMINO}PROPANOIC ACID is 21013-92-3.
Molecular formula C13H15N3O4S, molecular weight 309.34.
It is also registered under: 3-(1H-IMIDAZOL-4-YL)-2-{[(4-METHYLPHENYL)SULFONYL]AMINO}PROPANOIC ACID, 3-(1H-咪唑-4-YL)-2-{[(4-甲基苯基)磺酰]氨基}丙酸.
Category: Organic Chemicals.
Independent reference data for 3-(1H-IMIDAZOL-4-YL)-2-{[(4-METHYLPHENYL)SULFONYL]AMINO}PROPANOIC ACID (CAS 21013-92-3), compiled from public chemistry databases.
| CAS 号 | 21013-92-3 |
|---|---|
| PubChem CID | 259002 |
| 分子式 | C13H15N3O4S |
| IUPAC 名称 | 3-(1H-imidazol-5-yl)-2-[(4-methylphenyl)sulfonylamino]propanoic acid |
| UNII（FDA） | HMS2553H16 |
| Molecular Weight | 309.34 |
|---|---|
| XLogP3 | 1 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 6 |
| Exact Mass | 309.07832714 |
| Monoisotopic Mass | 309.07832714 |
| Topological Polar Surface Area | 121 |
| Heavy Atom Count | 21 |
N-[(4-Methylphenyl)sulfonyl]histidine; 3-(1H-imidazol-4-yl)-2-(4-methylbenzenesulfonamido)propanoic acid; 21013-92-3; 876027-98-4; 3-(3H-Imidazol-4-yl)-2-(toluene-4-sulfonylamino)-propionic acid; tosylhistidine; 3-(1H-Imidazol-4-yl)-2-(4-methylphenylsulfonamido)propanoic acid; N-p-toluenesulfonylhistidine; 3-imidazol-5-yl-2-{[(4-methylphenyl)sulfonyl]amino}propanoic acid; 3-(1H-imidazol-5-yl)-2-[(4-methylphenyl)sulfonylamino]propanoic acid; NSC88481; N(.alpha.)-Tosylhistidine; Cambridge id 5842520; NCIOpen2_009765; Oprea1_645599; Oprea1_750742
3-(1H-咪唑-4-YL)-2-{[(4-甲基苯基)磺酰]氨基}丙酸 · CAS 21013-92-3 · C13H15N3O4S. UNII HMS2553H16.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.