AB01291736-01
TL;DR: AB01291736-01 (CAS 896822-57-4) is a chemical compound with molecular formula C18H23N5O2S and molecular weight 373.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7,14,14-trimethyl-N-(2-methylpropyl)-13-oxa-10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene-4-carboxamide
Also Known As: AB01291736-01, 5,10,10-trimethyl-N-(2-methylpropyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide, N-isobutyl-5,10,10-trimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-2-carboxamide
| Molecular Formula | C18H23N5O2S |
|---|---|
| Molecular Weight | 373.16 g/mol |
| LogP | 2.88452 |
| Topological Polar Surface Area | 81.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 373.15726 |
| Heavy Atoms | 26 |
| Complexity | 1017.84564 |
Chemical Identifiers
| CAS Number | 896822-57-4 |
|---|---|
| SMILES | CC1=NC2=C(C3=C(S2)COC(C3)(C)C)C4=NC(=NN14)C(=O)NCC(C)C |
Product Overview
AB01291736-01 (CAS 896822-57-4), with molecular formula C18H23N5O2S and molecular weight 373.16 g/mol. IUPAC: 7,14,14-trimethyl-N-(2-methylpropyl)-13-oxa-10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene-4-carboxamide.
Chemical Property Profile of AB01291736-01
Property Insights of AB01291736-01
The XLogP value of 2.88452 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB01291736-01. The TPSA of 81.41 Ų falls within the moderate polarity range, balancing permeability and solubility for AB01291736-01. Following Lipinski's Rule of Five, AB01291736-01 has 1 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 AB01291736-01?
The CAS number of AB01291736-01 is 896822-57-4.
What is the molecular formula of AB01291736-01?
The molecular formula of AB01291736-01 is C18H23N5O2S.
What is the molecular weight of AB01291736-01?
The molecular weight of AB01291736-01 is 373.16 g/mol.
Where can I buy AB01291736-01?
You can request a quote for AB01291736-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01291736-01?
Yes, KEHONG BIO provides custom synthesis services for AB01291736-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.