F0537-0667
TL;DR: F0537-0667 (CAS 681171-07-3) is a chemical compound with molecular formula C18H13N3O6S and molecular weight 399.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-(5-nitro-1-benzothiophene-2-carbonyl)-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide
Also Known As: F0537-0667, N'-(5-nitro-1-benzothiophene-2-carbonyl)-2,3-dihydro-1,4-benzodioxine-2-carbohydrazide, N'-(5-nitro-1-benzothiophene-2-carbonyl)-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide, N'-(5-nitrobenzo[b]thiophene-2-carbonyl)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide, {2-[(2,3-dihydro-1,4-benzodioxin-2-yl)carbonyl]hydrazino}(5-nitro-1-benzothiophen-2-yl)methanone
| Molecular Formula | C18H13N3O6S |
|---|---|
| Molecular Weight | 399.05 g/mol |
| LogP | 2.4105 |
| Topological Polar Surface Area | 119.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 399.05252 |
| Heavy Atoms | 28 |
| Complexity | 1095.8694 |
Chemical Identifiers
| CAS Number | 681171-07-3 |
|---|---|
| SMILES | C1C(OC2=CC=CC=C2O1)C(=O)NNC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-] |
Product Overview
F0537-0667 (CAS 681171-07-3), with molecular formula C18H13N3O6S and molecular weight 399.05 g/mol. IUPAC: N'-(5-nitro-1-benzothiophene-2-carbonyl)-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide.
Chemical Property Profile of F0537-0667
Property Insights of F0537-0667
The XLogP value of 2.4105 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0537-0667. The TPSA of 119.8 Ų falls within the moderate polarity range, balancing permeability and solubility for F0537-0667. Following Lipinski's Rule of Five, F0537-0667 has 2 hydrogen bond donor(s) and 7 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 F0537-0667?
The CAS number of F0537-0667 is 681171-07-3.
What is the molecular formula of F0537-0667?
The molecular formula of F0537-0667 is C18H13N3O6S.
What is the molecular weight of F0537-0667?
The molecular weight of F0537-0667 is 399.05 g/mol.
Where can I buy F0537-0667?
You can request a quote for F0537-0667 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0537-0667?
Yes, KEHONG BIO provides custom synthesis services for F0537-0667 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.