F3168-2355
TL;DR: F3168-2355 (CAS 688061-88-3) is a chemical compound with molecular formula C27H22N4O7S and molecular weight 546.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[6-(2-amino-2-oxoethyl)sulfanyl-8-oxo-[1,3]dioxolo[4,5-g]quinazolin-7-yl]methyl]-N-(1,3-benzodioxol-5-ylmethyl)benzamide
Also Known As: F3168-2355, N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-({6-[(carbamoylmethyl)sulfanyl]-8-oxo-2H,7H,8H-[1,3]dioxolo[4,5-g]quinazolin-7-yl}methyl)benzamide, 4-((6-((2-amino-2-oxoethyl)thio)-8-oxo-[1,3]dioxolo[4,5-g]quinazolin-7(8H)-yl)methyl)-N-(benzo[d][1,3]dioxol-5-ylmethyl)benzamide, 4-[[6-(2-amino-2-oxoethyl)sulfanyl-8-oxo-[1,3]dioxolo[4,5-g]quinazolin-7-yl]methyl]-N-(1,3-benzodioxol-5-ylmethyl)benzamide
| Molecular Formula | C27H22N4O7S |
|---|---|
| Molecular Weight | 546.12 g/mol |
| LogP | 2.4096 |
| Topological Polar Surface Area | 144.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 546.1209 |
| Heavy Atoms | 39 |
| Complexity | 1670.0476 |
Chemical Identifiers
| CAS Number | 688061-88-3 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC=C(C=C3)CN4C(=O)C5=CC6=C(C=C5N=C4SCC(=O)N)OCO6 |
Product Overview
F3168-2355 (CAS 688061-88-3), with molecular formula C27H22N4O7S and molecular weight 546.12 g/mol. IUPAC: 4-[[6-(2-amino-2-oxoethyl)sulfanyl-8-oxo-[1,3]dioxolo[4,5-g]quinazolin-7-yl]methyl]-N-(1,3-benzodioxol-5-ylmethyl)benzamide.
Chemical Property Profile of F3168-2355
Property Insights of F3168-2355
The XLogP value of 2.4096 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F3168-2355. The TPSA of 144.0 Ų indicates high polarity, suggesting F3168-2355 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, F3168-2355 has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F3168-2355?
The CAS number of F3168-2355 is 688061-88-3.
What is the molecular formula of F3168-2355?
The molecular formula of F3168-2355 is C27H22N4O7S.
What is the molecular weight of F3168-2355?
The molecular weight of F3168-2355 is 546.12 g/mol.
Where can I buy F3168-2355?
You can request a quote for F3168-2355 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F3168-2355?
Yes, KEHONG BIO provides custom synthesis services for F3168-2355 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.