F1601-0577
TL;DR: F1601-0577 (CAS 866015-86-3) is a chemical compound with molecular formula C25H23ClN2O2S and molecular weight 450.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(3-chlorophenyl)methyl]-3-(4-ethylphenyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine-2,4-dione
Also Known As: F1601-0577, 1-(3-chlorobenzyl)-3-(4-ethylphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-2,4(1H,3H)-dione, 1-[(3-chlorophenyl)methyl]-3-(4-ethylphenyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine-2,4-dione, 6-[(3-chlorophenyl)methyl]-4-(4-ethylphenyl)-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7)-diene-3,5-dione, 1-(3-chlorobenzyl)-3-(4-ethylphenyl)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
| Molecular Formula | C25H23ClN2O2S |
|---|---|
| Molecular Weight | 450.12 g/mol |
| LogP | 5.3568 |
| Topological Polar Surface Area | 44.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 450.11688 |
| Heavy Atoms | 31 |
| Complexity | 1396.2975 |
Chemical Identifiers
| CAS Number | 866015-86-3 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)N2C(=O)C3=C(N(C2=O)CC4=CC(=CC=C4)Cl)SC5=C3CCCC5 |
Product Overview
F1601-0577 (CAS 866015-86-3), with molecular formula C25H23ClN2O2S and molecular weight 450.12 g/mol. IUPAC: 1-[(3-chlorophenyl)methyl]-3-(4-ethylphenyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine-2,4-dione.
Chemical Property Profile of F1601-0577
Property Insights of F1601-0577
The XLogP value of 5.3568 indicates that F1601-0577 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.0 Ų, F1601-0577 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F1601-0577 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F1601-0577?
The CAS number of F1601-0577 is 866015-86-3.
What is the molecular formula of F1601-0577?
The molecular formula of F1601-0577 is C25H23ClN2O2S.
What is the molecular weight of F1601-0577?
The molecular weight of F1601-0577 is 450.12 g/mol.
Where can I buy F1601-0577?
You can request a quote for F1601-0577 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1601-0577?
Yes, KEHONG BIO provides custom synthesis services for F1601-0577 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.