K284-5761
TL;DR: K284-5761 (CAS 896681-96-2) is a chemical compound with molecular formula C27H29N3O8S and molecular weight 555.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[7-[6-(1,3-benzodioxol-5-ylmethylamino)-6-oxohexyl]-8-oxo-[1,3]dioxolo[4,5-g]quinazolin-6-yl]sulfanyl]acetate
Also Known As: K284-5761, ethyl 2-{[7-(5-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}pentyl)-8-oxo-2H,7H,8H-[1,3]dioxolo[4,5-g]quinazolin-6-yl]sulfanyl}acetate, F3168-2287, ethyl 2-[[7-[6-(1,3-benzodioxol-5-ylmethylamino)-6-oxohexyl]-8-oxo-[1,3]dioxolo[4,5-g]quinazolin-6-yl]sulfanyl]acetate, ethyl [(7-{6-[(1,3-benzodioxol-5-ylmethyl)amino]-6-oxohexyl}-8-oxo-7,8-dihydro[1,3]dioxolo[4,5-g]quinazolin-6-yl)thio]acetate
| Molecular Formula | C27H29N3O8S |
|---|---|
| Molecular Weight | 555.17 g/mol |
| LogP | 3.3859 |
| Topological Polar Surface Area | 127.21 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 12 |
| Exact Mass | 555.16754 |
| Heavy Atoms | 39 |
| Complexity | 1440.7799 |
Chemical Identifiers
| CAS Number | 896681-96-2 |
|---|---|
| SMILES | CCOC(=O)CSC1=NC2=CC3=C(C=C2C(=O)N1CCCCCC(=O)NCC4=CC5=C(C=C4)OCO5)OCO3 |
Product Overview
K284-5761 (CAS 896681-96-2), with molecular formula C27H29N3O8S and molecular weight 555.17 g/mol. IUPAC: ethyl 2-[[7-[6-(1,3-benzodioxol-5-ylmethylamino)-6-oxohexyl]-8-oxo-[1,3]dioxolo[4,5-g]quinazolin-6-yl]sulfanyl]acetate.
Chemical Property Profile of K284-5761
Property Insights of K284-5761
The XLogP value of 3.3859 indicates that K284-5761 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 127.21 Ų falls within the moderate polarity range, balancing permeability and solubility for K284-5761. Following Lipinski's Rule of Five, K284-5761 has 1 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 K284-5761?
The CAS number of K284-5761 is 896681-96-2.
What is the molecular formula of K284-5761?
The molecular formula of K284-5761 is C27H29N3O8S.
What is the molecular weight of K284-5761?
The molecular weight of K284-5761 is 555.17 g/mol.
Where can I buy K284-5761?
You can request a quote for K284-5761 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for K284-5761?
Yes, KEHONG BIO provides custom synthesis services for K284-5761 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.