C19H18N4O3S
TL;DR: C19H18N4O3S (CAS 307346-58-3) is a chemical compound with molecular formula C19H18N4O3S and molecular weight 382.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[(E)-[[2-(1-methylbenzimidazol-2-yl)sulfanylacetyl]hydrazinylidene]methyl]benzoate
Also Known As: ME 4-(2-(((1-METHYL-1H-BENZIMIDAZOL-2-YL)THIO)ACETYL)CARBOHYDRAZONOYL)BENZOATE, methyl 4-{(1E)-2-[2-(1-methylbenzimidazol-2-ylthio)acetylamino]-2-azavinyl}ben zoate, (E)-methyl 4-((2-(2-((1-methyl-1H-benzo[d]imidazol-2-yl)thio)acetyl)hydrazono)methyl)benzoate, METHYL 4-[(E)-({2-[(1-METHYL-1H-1,3-BENZODIAZOL-2-YL)SULFANYL]ACETAMIDO}IMINO)METHYL]BENZOATE, methyl 4-[(E)-(2-{[(1-methyl-1H-benzimidazol-2-yl)sulfanyl]acetyl}hydrazinylidene)methyl]benzoate
| Molecular Formula | C19H18N4O3S |
|---|---|
| Molecular Weight | 382.11 g/mol |
| LogP | 2.6023 |
| Topological Polar Surface Area | 85.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 382.10995 |
| Heavy Atoms | 27 |
| Complexity | 995.86237 |
Chemical Identifiers
| CAS Number | 307346-58-3 |
|---|---|
| SMILES | CN1C2=CC=CC=C2N=C1SCC(=O)N/N=C/C3=CC=C(C=C3)C(=O)OC |
Product Overview
C19H18N4O3S (CAS 307346-58-3), with molecular formula C19H18N4O3S and molecular weight 382.11 g/mol. IUPAC: methyl 4-[(E)-[[2-(1-methylbenzimidazol-2-yl)sulfanylacetyl]hydrazinylidene]methyl]benzoate.
Chemical Property Profile of C19H18N4O3S
Property Insights of C19H18N4O3S
The XLogP value of 2.6023 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C19H18N4O3S. The TPSA of 85.58 Ų falls within the moderate polarity range, balancing permeability and solubility for C19H18N4O3S. Following Lipinski's Rule of Five, C19H18N4O3S has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C19H18N4O3S?
The CAS number of C19H18N4O3S is 307346-58-3.
What is the molecular formula of C19H18N4O3S?
The molecular formula of C19H18N4O3S is C19H18N4O3S.
What is the molecular weight of C19H18N4O3S?
The molecular weight of C19H18N4O3S is 382.11 g/mol.
Where can I buy C19H18N4O3S?
You can request a quote for C19H18N4O3S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C19H18N4O3S?
Yes, KEHONG BIO provides custom synthesis services for C19H18N4O3S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.