Carbazic acid, 3-(5-nitrofurfurylidene)dithio-, methyl ester
TL;DR: Carbazic acid, 3-(5-nitrofurfurylidene)dithio-, methyl ester (CAS 501648-63-1) is a chemical compound with molecular formula C7H7N3O3S2 and molecular weight 244.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-[(E)-(5-nitrofuran-2-yl)methylideneamino]carbamodithioate
Also Known As: 3- dithiocarbazicacidmethylester, Methyl 3-(5-nitrofurfurylidene)dithiocarbazate, 1-prop-2-enoxy-3-trityloxybenzene, Methyl 3-[5-nitrofurylidene]dithiocarbazate, CARBAZIC ACID, 3-(5-NITROFURFURYLIDENE)DITHIO-, METHYL ESTER
| Molecular Formula | C7H7N3O3S2 |
|---|---|
| Molecular Weight | 244.99 g/mol |
| LogP | 1.7592 |
| Topological Polar Surface Area | 80.67 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 244.99289 |
| Heavy Atoms | 15 |
| Complexity | 401.9396 |
Chemical Identifiers
| CAS Number | 501648-63-1 |
|---|---|
| SMILES | CSC(=S)N/N=C/C1=CC=C(O1)[N+](=O)[O-] |
Product Overview
Carbazic acid, 3-(5-nitrofurfurylidene)dithio-, methyl ester (CAS 501648-63-1), with molecular formula C7H7N3O3S2 and molecular weight 244.99 g/mol. IUPAC: methyl N-[(E)-(5-nitrofuran-2-yl)methylideneamino]carbamodithioate.
Chemical Property Profile of Carbazic acid, 3-(5-nitrofurfurylidene)dithio-, methyl ester
Property Insights of Carbazic acid, 3-(5-nitrofurfurylidene)dithio-, methyl ester
The XLogP value of 1.7592 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbazic acid, 3-(5-nitrofurfurylidene)dithio-, methyl ester. The TPSA of 80.67 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbazic acid, 3-(5-nitrofurfurylidene)dithio-, methyl ester. Following Lipinski's Rule of Five, Carbazic acid, 3-(5-nitrofurfurylidene)dithio-, methyl ester 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 Carbazic acid, 3-(5-nitrofurfurylidene)dithio-, methyl ester?
The CAS number of Carbazic acid, 3-(5-nitrofurfurylidene)dithio-, methyl ester is 501648-63-1.
What is the molecular formula of Carbazic acid, 3-(5-nitrofurfurylidene)dithio-, methyl ester?
The molecular formula of Carbazic acid, 3-(5-nitrofurfurylidene)dithio-, methyl ester is C7H7N3O3S2.
What is the molecular weight of Carbazic acid, 3-(5-nitrofurfurylidene)dithio-, methyl ester?
The molecular weight of Carbazic acid, 3-(5-nitrofurfurylidene)dithio-, methyl ester is 244.99 g/mol.
Where can I buy Carbazic acid, 3-(5-nitrofurfurylidene)dithio-, methyl ester?
You can request a quote for Carbazic acid, 3-(5-nitrofurfurylidene)dithio-, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbazic acid, 3-(5-nitrofurfurylidene)dithio-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbazic acid, 3-(5-nitrofurfurylidene)dithio-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.