AB01302750-01
TL;DR: AB01302750-01 (CAS 903585-44-4) is a chemical compound with molecular formula C15H21N3O2S2 and molecular weight 339.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(11,11-dimethyl-4-methylsulfanyl-12-oxa-8-thia-3,5-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraen-6-yl)-methylamino]ethanol
Also Known As: AB01302750-01, 2-{[7,7-dimethyl-2-(methylsulfanyl)-6,9-dihydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidin-4-yl](methyl)amino}ethanol, 2-((7,7-dimethyl-2-(methylthio)-7,9-dihydro-6H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidin-4-yl)(methyl)amino)ethanol, 2-[(7,7-dimethyl-2-methylsulfanyl-6,9-dihydropyrano[2,3]thieno[2,4-b]pyrimidin-4-yl)-methylamino]ethanol
| Molecular Formula | C15H21N3O2S2 |
|---|---|
| Molecular Weight | 339.11 g/mol |
| LogP | 2.693 |
| Topological Polar Surface Area | 58.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 339.1075 |
| Heavy Atoms | 22 |
| Complexity | 699.64264 |
Chemical Identifiers
| CAS Number | 903585-44-4 |
|---|---|
| SMILES | CC1(CC2=C(CO1)C3=C(S2)C(=NC(=N3)SC)N(C)CCO)C |
Product Overview
AB01302750-01 (CAS 903585-44-4), with molecular formula C15H21N3O2S2 and molecular weight 339.11 g/mol. IUPAC: 2-[(11,11-dimethyl-4-methylsulfanyl-12-oxa-8-thia-3,5-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraen-6-yl)-methylamino]ethanol.
Chemical Property Profile of AB01302750-01
Property Insights of AB01302750-01
The XLogP value of 2.693 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB01302750-01. With a topological polar surface area (TPSA) of 58.48 Ų, AB01302750-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB01302750-01 has 1 hydrogen bond donor(s) and 7 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 AB01302750-01?
The CAS number of AB01302750-01 is 903585-44-4.
What is the molecular formula of AB01302750-01?
The molecular formula of AB01302750-01 is C15H21N3O2S2.
What is the molecular weight of AB01302750-01?
The molecular weight of AB01302750-01 is 339.11 g/mol.
Where can I buy AB01302750-01?
You can request a quote for AB01302750-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01302750-01?
Yes, KEHONG BIO provides custom synthesis services for AB01302750-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.