AB01302049-01
TL;DR: AB01302049-01 (CAS 488101-42-4) is a chemical compound with molecular formula C18H22N4OS and molecular weight 342.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(7-butyl-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-yl)amino]ethanol
Also Known As: AB01302049-01, 2-((4-butyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino)ethanol, 2-[(4-butyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino]ethanol
| Molecular Formula | C18H22N4OS |
|---|---|
| Molecular Weight | 342.15 g/mol |
| LogP | 3.475 |
| Topological Polar Surface Area | 70.93 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 342.15143 |
| Heavy Atoms | 24 |
| Complexity | 889.7279 |
Chemical Identifiers
| CAS Number | 488101-42-4 |
|---|---|
| SMILES | CCCCC1=NC2=C(C3=C1CCC3)C4=C(S2)C(=NC=N4)NCCO |
Product Overview
AB01302049-01 (CAS 488101-42-4), with molecular formula C18H22N4OS and molecular weight 342.15 g/mol. IUPAC: 2-[(7-butyl-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-yl)amino]ethanol.
Chemical Property Profile of AB01302049-01
Property Insights of AB01302049-01
The XLogP value of 3.475 indicates that AB01302049-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.93 Ų falls within the moderate polarity range, balancing permeability and solubility for AB01302049-01. Following Lipinski's Rule of Five, AB01302049-01 has 2 hydrogen bond donor(s) and 6 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 AB01302049-01?
The CAS number of AB01302049-01 is 488101-42-4.
What is the molecular formula of AB01302049-01?
The molecular formula of AB01302049-01 is C18H22N4OS.
What is the molecular weight of AB01302049-01?
The molecular weight of AB01302049-01 is 342.15 g/mol.
Where can I buy AB01302049-01?
You can request a quote for AB01302049-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01302049-01?
Yes, KEHONG BIO provides custom synthesis services for AB01302049-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.