F3394-0589
TL;DR: F3394-0589 (CAS 690645-35-3) is a chemical compound with molecular formula C27H27N3O4S2 and molecular weight 521.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]sulfanyl-5,6-dimethyl-3-phenylthieno[2,3-d]pyrimidin-4-one
Also Known As: F3394-0589, 2-{[2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-yl)-2-oxoethyl]sulfanyl}-5,6-dimethyl-3-phenyl-3H,4H-thieno[2,3-d]pyrimidin-4-one, 2-((2-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl)thio)-5,6-dimethyl-3-phenylthieno[2,3-d]pyrimidin-4(3H)-one, 2-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]sulfanyl-5,6-dimethyl-3-phenylthieno[2,3-d]pyrimidin-4-one, 6-[2-(6,7-dimethoxy-1,2,3,4-tetrahydro-2-isoquinolyl)-2-oxoethylthio]-2,3-dimethyl-5-phenyl-1-thia-5,7-diaza-4(5H)-indenone
| Molecular Formula | C27H27N3O4S2 |
|---|---|
| Molecular Weight | 521.14 g/mol |
| LogP | 4.75824 |
| Topological Polar Surface Area | 73.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 521.1443 |
| Heavy Atoms | 36 |
| Complexity | 1511.4701 |
Chemical Identifiers
| CAS Number | 690645-35-3 |
|---|---|
| SMILES | CC1=C(SC2=C1C(=O)N(C(=N2)SCC(=O)N3CCC4=CC(=C(C=C4C3)OC)OC)C5=CC=CC=C5)C |
Product Overview
F3394-0589 (CAS 690645-35-3), with molecular formula C27H27N3O4S2 and molecular weight 521.14 g/mol. IUPAC: 2-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]sulfanyl-5,6-dimethyl-3-phenylthieno[2,3-d]pyrimidin-4-one.
Chemical Property Profile of F3394-0589
Property Insights of F3394-0589
The XLogP value of 4.75824 indicates that F3394-0589 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.66 Ų falls within the moderate polarity range, balancing permeability and solubility for F3394-0589. Following Lipinski's Rule of Five, F3394-0589 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F3394-0589?
The CAS number of F3394-0589 is 690645-35-3.
What is the molecular formula of F3394-0589?
The molecular formula of F3394-0589 is C27H27N3O4S2.
What is the molecular weight of F3394-0589?
The molecular weight of F3394-0589 is 521.14 g/mol.
Where can I buy F3394-0589?
You can request a quote for F3394-0589 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F3394-0589?
Yes, KEHONG BIO provides custom synthesis services for F3394-0589 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.