AB01290747-01
TL;DR: AB01290747-01 (CAS 900888-88-2) is a chemical compound with molecular formula C25H28N6O2S and molecular weight 476.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-anilino-11,11-dimethyl-5-(2-oxo-2-piperidin-1-ylethyl)sulfanyl-12-oxa-3,4,6-triazatricyclo[7.4.0.02,6]trideca-1(9),2,4,7-tetraene-8-carbonitrile
Also Known As: AB01290747-01, 8,8-dimethyl-3-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}-5-(phenylamino)-7,10-dihydro-8H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile, 8,8-dimethyl-3-((2-oxo-2-(piperidin-1-yl)ethyl)thio)-5-(phenylamino)-8,10-dihydro-7H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile
| Molecular Formula | C25H28N6O2S |
|---|---|
| Molecular Weight | 476.20 g/mol |
| LogP | 4.30048 |
| Topological Polar Surface Area | 95.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 476.19943 |
| Heavy Atoms | 34 |
| Complexity | 1258.1318 |
Chemical Identifiers
| CAS Number | 900888-88-2 |
|---|---|
| SMILES | CC1(CC2=C(CO1)C3=NN=C(N3C(=C2C#N)NC4=CC=CC=C4)SCC(=O)N5CCCCC5)C |
Product Overview
AB01290747-01 (CAS 900888-88-2), with molecular formula C25H28N6O2S and molecular weight 476.20 g/mol. IUPAC: 7-anilino-11,11-dimethyl-5-(2-oxo-2-piperidin-1-ylethyl)sulfanyl-12-oxa-3,4,6-triazatricyclo[7.4.0.02,6]trideca-1(9),2,4,7-tetraene-8-carbonitrile.
Chemical Property Profile of AB01290747-01
Property Insights of AB01290747-01
The XLogP value of 4.30048 indicates that AB01290747-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.55 Ų falls within the moderate polarity range, balancing permeability and solubility for AB01290747-01. Following Lipinski's Rule of Five, AB01290747-01 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 AB01290747-01?
The CAS number of AB01290747-01 is 900888-88-2.
What is the molecular formula of AB01290747-01?
The molecular formula of AB01290747-01 is C25H28N6O2S.
What is the molecular weight of AB01290747-01?
The molecular weight of AB01290747-01 is 476.20 g/mol.
Where can I buy AB01290747-01?
You can request a quote for AB01290747-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01290747-01?
Yes, KEHONG BIO provides custom synthesis services for AB01290747-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.