3-[[[[(3-METHOXY-2-NAPHTHALENYL)CARBONYL]AMINO]THIOXOMETHYL]AMINO]-4-METHYL-BENZOIC ACID (CAS 433697-67-7) — formula C21H18N2O4S, molecular weight 394.4; category organic chemicals.
| CAS Number | 433697-67-7 |
|---|---|
| Molecular Formula | C21H18N2O4S |
| Molecular Weight | 394.4 |
| LogP | 4.6 |
| Category | Organic Chemicals |
3-[[[[(3-METHOXY-2-NAPHTHALENYL)CARBONYL]AMINO]THIOXOMETHYL]AMINO]-4-METHYL-BENZOIC ACID is a carbon-based organic compound with CAS registry number 433697-67-7 and molecular formula C21H18N2O4S (molecular weight 394.4), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 433697-67-7
Its molecular formula C21H18N2O4S comprises 21 C, 18 H, 2 N, 4 O, 1 S atoms.
Also known as: 3-[[[[(3-METHOXY-2-NAPHTHALENYL)CARBONYL]AMINO]THIOXOMETHYL]AMINO]-4-METHYL-BENZOIC ACID · 3-[[[[(3-甲氧基-2-萘基)羰基]氨基]硫代甲基]氨基]-4-甲基苯甲酸
Category: organic chemicals
The CAS registry number of 3-[[[[(3-METHOXY-2-NAPHTHALENYL)CARBONYL]AMINO]THIOXOMETHYL]AMINO]-4-METHYL-BENZOIC ACID is 433697-67-7.
Molecular formula C21H18N2O4S, molecular weight 394.4.
It is also registered under: 3-[[[[(3-METHOXY-2-NAPHTHALENYL)CARBONYL]AMINO]THIOXOMETHYL]AMINO]-4-METHYL-BENZOIC ACID, 3-[[[[(3-甲氧基-2-萘基)羰基]氨基]硫代甲基]氨基]-4-甲基苯甲酸.
Category: Organic Chemicals.
Independent reference data for 3-[[[[(3-METHOXY-2-NAPHTHALENYL)CARBONYL]AMINO]THIOXOMETHYL]AMINO]-4-METHYL-BENZOIC ACID (CAS 433697-67-7), compiled from public chemistry databases.
| CAS 号 | 433697-67-7 |
|---|---|
| PubChem CID | 1870190 |
| 分子式 | C21H18N2O4S |
| IUPAC 名称 | 3-[(3-methoxynaphthalene-2-carbonyl)carbamothioylamino]-4-methylbenzoic acid |
| UNII（FDA） | HMS2663M08 |
| Molecular Weight | 394.4 |
|---|---|
| XLogP3 | 4.6 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 4 |
| Exact Mass | 394.09872823 |
| Monoisotopic Mass | 394.09872823 |
| Topological Polar Surface Area | 120 |
| Heavy Atom Count | 28 |
MLS000690670; SMR000298924; 3-({[(3-methoxy-2-naphthoyl)amino]carbonothioyl}amino)-4-methylbenzoic acid; 433697-67-7; Oprea1_110911; CHEMBL1594443; BDBM45595; cid_1870190; HMS2663M08; STK108172; 3-[(3-methoxynaphthalene-2-carbonyl)carbamothioylamino]-4-methylbenzoic acid; AKOS000103231; 3-({[(3-methoxynaphthalen-2-yl)carbonyl]carbamothioyl}amino)-4-methylbenzoic acid; 3-(3-(3-methoxy-2-naphthoyl)thioureido)-4-methylbenzoic acid; 3-[(3-methoxy-2-naphthoyl)thiocarbamoylamino]-4-methyl-benzoic acid; 3-[(3-methoxynaphthalen-2-yl)carbonylcarbamothioylamino]-4-methyl-benzoic acid
3-[[[[(3-甲氧基-2-萘基)羰基]氨基]硫代甲基]氨基]-4-甲基苯甲酸 · CAS 433697-67-7 · C21H18N2O4S. UNII HMS2663M08.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.