F3168-2110
TL;DR: F3168-2110 (CAS 896705-80-9) is a chemical compound with molecular formula C27H24N4O8S and molecular weight 564.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-ylmethyl)-3-[6-[2-(furan-2-ylmethylamino)-2-oxoethyl]sulfanyl-8-oxo-[1,3]dioxolo[4,5-g]quinazolin-7-yl]propanamide
Also Known As: F3168-2110, N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-{6-[({[(furan-2-yl)methyl]carbamoyl}methyl)sulfanyl]-8-oxo-2H,7H,8H-[1,3]dioxolo[4,5-g]quinazolin-7-yl}propanamide, N-(1,3-benzodioxol-5-ylmethyl)-3-[6-[2-(furan-2-ylmethylamino)-2-oxoethyl]sulfanyl-8-oxo-[1,3]dioxolo[4,5-g]quinazolin-7-yl]propanamide, N-(1,3-benzodioxol-5-ylmethyl)-3-[6-({2-[(2-furylmethyl)amino]-2-oxoethyl}thio)-8-oxo[1,3]dioxolo[4,5-g]quinazolin-7(8H)-yl]propanamide, N-(benzo[d][1,3]dioxol-5-ylmethyl)-3-(6-((2-((furan-2-ylmethyl)amino)-2-oxoethyl)thio)-8-oxo-[1,3]dioxolo[4,5-g]quinazolin-7(8H)-yl)propanamide
| Molecular Formula | C27H24N4O8S |
|---|---|
| Molecular Weight | 564.13 g/mol |
| LogP | 2.5619 |
| Topological Polar Surface Area | 143.15 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 10 |
| Exact Mass | 564.1315 |
| Heavy Atoms | 40 |
| Complexity | 1636.0415 |
Chemical Identifiers
| CAS Number | 896705-80-9 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)CNC(=O)CCN3C(=O)C4=CC5=C(C=C4N=C3SCC(=O)NCC6=CC=CO6)OCO5 |
Product Overview
F3168-2110 (CAS 896705-80-9), with molecular formula C27H24N4O8S and molecular weight 564.13 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethyl)-3-[6-[2-(furan-2-ylmethylamino)-2-oxoethyl]sulfanyl-8-oxo-[1,3]dioxolo[4,5-g]quinazolin-7-yl]propanamide.
Chemical Property Profile of F3168-2110
Property Insights of F3168-2110
The XLogP value of 2.5619 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F3168-2110. The TPSA of 143.15 Ų indicates high polarity, suggesting F3168-2110 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, F3168-2110 has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F3168-2110?
The CAS number of F3168-2110 is 896705-80-9.
What is the molecular formula of F3168-2110?
The molecular formula of F3168-2110 is C27H24N4O8S.
What is the molecular weight of F3168-2110?
The molecular weight of F3168-2110 is 564.13 g/mol.
Where can I buy F3168-2110?
You can request a quote for F3168-2110 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F3168-2110?
Yes, KEHONG BIO provides custom synthesis services for F3168-2110 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.