F1602-0420
TL;DR: F1602-0420 (CAS 866344-40-3) is a chemical compound with molecular formula C27H25FN4O5S and molecular weight 536.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(4-fluorophenyl)-6-[2-(2-methylanilino)-2-oxoethyl]-3,5-dioxo-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-diene-11-carboxylate
Also Known As: F1602-0420, ethyl 4-(4-fluorophenyl)-6-{[(2-methylphenyl)carbamoyl]methyl}-3,5-dioxo-8-thia-4,6,11-triazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7)-diene-11-carboxylate, ethyl 3-(4-fluorophenyl)-1-{2-[(2-methylphenyl)amino]-2-oxoethyl}-2,4-dioxo-1,3,4,5,6,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-7(2H)-carboxylate, ethyl 3-(4-fluorophenyl)-2,4-dioxo-1-(2-oxo-2-(o-tolylamino)ethyl)-1,2,3,4,5,6-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-7(8H)-carboxylate, ETHYL 3-(4-FLUOROPHENYL)-2,4-DIOXO-1-[2-OXO-2-(2-TOLUIDINO)ETHYL]-1,3,4,5,6,8-HEXAHYDROPYRIDO[4',3':4,5]THIENO[2,3-D]PYRIMIDINE-7(2H)-CARBOXYLATE
| Molecular Formula | C27H25FN4O5S |
|---|---|
| Molecular Weight | 536.15 g/mol |
| LogP | 3.81472 |
| Topological Polar Surface Area | 102.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 536.15295 |
| Heavy Atoms | 38 |
| Complexity | 1672.0272 |
Chemical Identifiers
| CAS Number | 866344-40-3 |
|---|---|
| SMILES | CCOC(=O)N1CCC2=C(C1)SC3=C2C(=O)N(C(=O)N3CC(=O)NC4=CC=CC=C4C)C5=CC=C(C=C5)F |
Product Overview
F1602-0420 (CAS 866344-40-3), with molecular formula C27H25FN4O5S and molecular weight 536.15 g/mol. IUPAC: ethyl 4-(4-fluorophenyl)-6-[2-(2-methylanilino)-2-oxoethyl]-3,5-dioxo-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-diene-11-carboxylate.
Chemical Property Profile of F1602-0420
Property Insights of F1602-0420
The XLogP value of 3.81472 indicates that F1602-0420 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.64 Ų falls within the moderate polarity range, balancing permeability and solubility for F1602-0420. Following Lipinski's Rule of Five, F1602-0420 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F1602-0420?
The CAS number of F1602-0420 is 866344-40-3.
What is the molecular formula of F1602-0420?
The molecular formula of F1602-0420 is C27H25FN4O5S.
What is the molecular weight of F1602-0420?
The molecular weight of F1602-0420 is 536.15 g/mol.
Where can I buy F1602-0420?
You can request a quote for F1602-0420 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1602-0420?
Yes, KEHONG BIO provides custom synthesis services for F1602-0420 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.