F1222-0400
TL;DR: F1222-0400 (CAS 455927-66-9) is a chemical compound with molecular formula C18H16FN3O2S and molecular weight 357.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-fluorophenyl)-4-(4-hydroxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide
Also Known As: F1222-0400, N-(4-fluorophenyl)-4-(4-hydroxyphenyl)-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxamide, N-(4-fluorophenyl)-4-(4-hydroxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide, N-(4-fluorophenyl)-4-(4-hydroxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxamide, N-(4-fluorophenyl)-6-(4-hydroxyphenyl)-4-methyl-2-sulfanyl-1,6-dihydropyrimidine-5-carboxamide
| Molecular Formula | C18H16FN3O2S |
|---|---|
| Molecular Weight | 357.09 g/mol |
| LogP | 2.9628 |
| Topological Polar Surface Area | 73.39 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 357.09473 |
| Heavy Atoms | 25 |
| Complexity | 847.6298 |
Chemical Identifiers
| CAS Number | 455927-66-9 |
|---|---|
| SMILES | CC1=C(C(NC(=S)N1)C2=CC=C(C=C2)O)C(=O)NC3=CC=C(C=C3)F |
Product Overview
F1222-0400 (CAS 455927-66-9), with molecular formula C18H16FN3O2S and molecular weight 357.09 g/mol. IUPAC: N-(4-fluorophenyl)-4-(4-hydroxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide.
Chemical Property Profile of F1222-0400
Property Insights of F1222-0400
The XLogP value of 2.9628 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F1222-0400. The TPSA of 73.39 Ų falls within the moderate polarity range, balancing permeability and solubility for F1222-0400. Following Lipinski's Rule of Five, F1222-0400 has 4 hydrogen bond donor(s) and 3 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 F1222-0400?
The CAS number of F1222-0400 is 455927-66-9.
What is the molecular formula of F1222-0400?
The molecular formula of F1222-0400 is C18H16FN3O2S.
What is the molecular weight of F1222-0400?
The molecular weight of F1222-0400 is 357.09 g/mol.
Where can I buy F1222-0400?
You can request a quote for F1222-0400 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1222-0400?
Yes, KEHONG BIO provides custom synthesis services for F1222-0400 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.