F0598-0377
TL;DR: F0598-0377 (CAS 690252-87-0) is a chemical compound with molecular formula C21H17N3O2S and molecular weight 375.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-10-methyl-6-thia-1,8-diazatricyclo[7.4.0.03,7]trideca-3(7),4,8,10,12-pentaen-2-one
Also Known As: F0598-0377, 2-(3,4-dihydroisoquinolin-2(1H)-ylcarbonyl)-9-methyl-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidin-4-one, 2-[3,4-DIHYDRO-2(1H)-ISOQUINOLINYLCARBONYL]-9-METHYL-4H-PYRIDO[1,2-A]THIENO[2,3-D]PYRIMIDIN-4-ONE, 9-methyl-2-(1,2,3,4-tetrahydroisoquinoline-2-carbonyl)-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidin-4-one
| Molecular Formula | C21H17N3O2S |
|---|---|
| Molecular Weight | 375.10 g/mol |
| LogP | 3.41612 |
| Topological Polar Surface Area | 54.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 375.10416 |
| Heavy Atoms | 27 |
| Complexity | 1271.638 |
Chemical Identifiers
| CAS Number | 690252-87-0 |
|---|---|
| SMILES | CC1=CC=CN2C1=NC3=C(C2=O)C=C(S3)C(=O)N4CCC5=CC=CC=C5C4 |
Product Overview
F0598-0377 (CAS 690252-87-0), with molecular formula C21H17N3O2S and molecular weight 375.10 g/mol. IUPAC: 5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-10-methyl-6-thia-1,8-diazatricyclo[7.4.0.03,7]trideca-3(7),4,8,10,12-pentaen-2-one.
Chemical Property Profile of F0598-0377
Property Insights of F0598-0377
The XLogP value of 3.41612 indicates that F0598-0377 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.68 Ų, F0598-0377 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F0598-0377 has 0 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 F0598-0377?
The CAS number of F0598-0377 is 690252-87-0.
What is the molecular formula of F0598-0377?
The molecular formula of F0598-0377 is C21H17N3O2S.
What is the molecular weight of F0598-0377?
The molecular weight of F0598-0377 is 375.10 g/mol.
Where can I buy F0598-0377?
You can request a quote for F0598-0377 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0598-0377?
Yes, KEHONG BIO provides custom synthesis services for F0598-0377 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.