F0598-0412
TL;DR: F0598-0412 (CAS 690253-21-5) is a chemical compound with molecular formula C19H14ClN3O2S and molecular weight 383.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chloro-4-methylphenyl)-10-methyl-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: F0598-0412, N-(3-chloro-4-methylphenyl)-9-methyl-4-oxo-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidine-2-carboxamide, N-(3-chloro-4-methylphenyl)-10-methyl-2-oxo-6-thia-1,8-diazatricyclo[7.4.0.03,7]trideca-3(7),4,8,10,12-pentaene-5-carboxamide
| Molecular Formula | C19H14ClN3O2S |
|---|---|
| Molecular Weight | 383.05 g/mol |
| LogP | 4.43174 |
| Topological Polar Surface Area | 63.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 383.04953 |
| Heavy Atoms | 26 |
| Complexity | 1242.9744 |
Chemical Identifiers
| CAS Number | 690253-21-5 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=O)C2=CC3=C(S2)N=C4C(=CC=CN4C3=O)C)Cl |
Product Overview
F0598-0412 (CAS 690253-21-5), with molecular formula C19H14ClN3O2S and molecular weight 383.05 g/mol. IUPAC: N-(3-chloro-4-methylphenyl)-10-methyl-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 F0598-0412
Property Insights of F0598-0412
The XLogP value of 4.43174 indicates that F0598-0412 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.47 Ų falls within the moderate polarity range, balancing permeability and solubility for F0598-0412. Following Lipinski's Rule of Five, F0598-0412 has 1 hydrogen bond donor(s) and 4 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 F0598-0412?
The CAS number of F0598-0412 is 690253-21-5.
What is the molecular formula of F0598-0412?
The molecular formula of F0598-0412 is C19H14ClN3O2S.
What is the molecular weight of F0598-0412?
The molecular weight of F0598-0412 is 383.05 g/mol.
Where can I buy F0598-0412?
You can request a quote for F0598-0412 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0598-0412?
Yes, KEHONG BIO provides custom synthesis services for F0598-0412 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.