F0598-0064
TL;DR: F0598-0064 (CAS 690250-40-9) is a chemical compound with molecular formula C18H11N3O4S and molecular weight 365.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-yl)-2-oxo-6-thia-1,8-diazatricyclo[7.4.0.03,7]trideca-3(7),4,8,10,12-pentaene-5-carboxamide
Also Known As: F0598-0064, N-1,3-benzodioxol-5-yl-4-oxo-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidine-2-carboxamide, N-(benzo[d][1,3]dioxol-5-yl)-4-oxo-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidine-2-carboxamide, N-(1,3-BENZODIOXOL-5-YL)-4-OXO-4H-PYRIDO[1,2-A]THIENO[2,3-D]PYRIMIDINE-2-CARBOXAMIDE
| Molecular Formula | C18H11N3O4S |
|---|---|
| Molecular Weight | 365.05 g/mol |
| LogP | 2.8902 |
| Topological Polar Surface Area | 81.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 365.04703 |
| Heavy Atoms | 26 |
| Complexity | 1244.3812 |
Chemical Identifiers
| CAS Number | 690250-40-9 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)NC(=O)C3=CC4=C(S3)N=C5C=CC=CN5C4=O |
Product Overview
F0598-0064 (CAS 690250-40-9), with molecular formula C18H11N3O4S and molecular weight 365.05 g/mol. IUPAC: N-(1,3-benzodioxol-5-yl)-2-oxo-6-thia-1,8-diazatricyclo[7.4.0.03,7]trideca-3(7),4,8,10,12-pentaene-5-carboxamide.
Chemical Property Profile of F0598-0064
Property Insights of F0598-0064
The XLogP value of 2.8902 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0598-0064. The TPSA of 81.93 Ų falls within the moderate polarity range, balancing permeability and solubility for F0598-0064. Following Lipinski's Rule of Five, F0598-0064 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 F0598-0064?
The CAS number of F0598-0064 is 690250-40-9.
What is the molecular formula of F0598-0064?
The molecular formula of F0598-0064 is C18H11N3O4S.
What is the molecular weight of F0598-0064?
The molecular weight of F0598-0064 is 365.05 g/mol.
Where can I buy F0598-0064?
You can request a quote for F0598-0064 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0598-0064?
Yes, KEHONG BIO provides custom synthesis services for F0598-0064 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.