AL-281/41529738
TL;DR: AL-281/41529738 (CAS 381203-79-8) is a chemical compound with molecular formula C24H24N4O4S2 and molecular weight 496.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-[(8-morpholin-4-yl-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1,7,9,12,14,16-hexaen-13-yl)sulfanylmethyl]furan-2-carboxylate
Also Known As: AL-281/41529738, methyl 5-(((5-morpholino-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl)thio)methyl)furan-2-carboxylate, methyl 5-({[5-(morpholin-4-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]sulfanyl}methyl)furan-2-carboxylate, Methyl 5-[(8-morpholin-4-yl-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1,7,9,12,14,16-hexaen-13-yl)sulfanylmethyl]furan-2-carboxylate, methyl 5-{[(5-morpholin-4-yl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl)sulfanyl]methyl}-2-furoate
| Molecular Formula | C24H24N4O4S2 |
|---|---|
| Molecular Weight | 496.12 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 144.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 496.1239 |
| Heavy Atoms | 34 |
| Complexity | 729.0 |
Chemical Identifiers
| CAS Number | 381203-79-8 |
|---|---|
| SMILES | COC(=O)C1=CC=C(O1)CSC2=NC=NC3=C2SC4=C3C5=C(CCCC5)C(=N4)N6CCOCC6 |
| InChIKey | IXAHJHDNGJWSMK-UHFFFAOYSA-N |
Product Overview
AL-281/41529738 (CAS 381203-79-8), with molecular formula C24H24N4O4S2 and molecular weight 496.12 g/mol. IUPAC: methyl 5-[(8-morpholin-4-yl-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1,7,9,12,14,16-hexaen-13-yl)sulfanylmethyl]furan-2-carboxylate.
Chemical Property Profile of AL-281/41529738
Property Insights of AL-281/41529738
The XLogP value of 5.0 indicates that AL-281/41529738 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 144.0 Ų indicates high polarity, suggesting AL-281/41529738 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, AL-281/41529738 has 0 hydrogen bond donor(s) and 10 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 AL-281/41529738?
The CAS number of AL-281/41529738 is 381203-79-8.
What is the molecular formula of AL-281/41529738?
The molecular formula of AL-281/41529738 is C24H24N4O4S2.
What is the molecular weight of AL-281/41529738?
The molecular weight of AL-281/41529738 is 496.12 g/mol.
Where can I buy AL-281/41529738?
You can request a quote for AL-281/41529738 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AL-281/41529738?
Yes, KEHONG BIO provides custom synthesis services for AL-281/41529738 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.