AB01301761-01
TL;DR: AB01301761-01 (CAS 903850-97-5) is a chemical compound with molecular formula C20H20N2O4S and molecular weight 384.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,11,11-trimethyl-3-phenacyl-12-oxa-8-thia-3,5-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-diene-4,6-dione
Also Known As: AB01301761-01, 3,7,7-trimethyl-1-(2-oxo-2-phenylethyl)-6,7-dihydro-1H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidine-2,4(3H,9H)-dione, 3,7,7-trimethyl-1-(2-oxo-2-phenylethyl)-6,9-dihydro-7H-pyrano[3',4':4,5]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
| Molecular Formula | C20H20N2O4S |
|---|---|
| Molecular Weight | 384.11 g/mol |
| LogP | 2.4959 |
| Topological Polar Surface Area | 70.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 384.11438 |
| Heavy Atoms | 27 |
| Complexity | 1168.6404 |
Chemical Identifiers
| CAS Number | 903850-97-5 |
|---|---|
| SMILES | CC1(CC2=C(CO1)C3=C(S2)C(=O)N(C(=O)N3CC(=O)C4=CC=CC=C4)C)C |
Product Overview
AB01301761-01 (CAS 903850-97-5), with molecular formula C20H20N2O4S and molecular weight 384.11 g/mol. IUPAC: 5,11,11-trimethyl-3-phenacyl-12-oxa-8-thia-3,5-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-diene-4,6-dione.
Chemical Property Profile of AB01301761-01
Property Insights of AB01301761-01
The XLogP value of 2.4959 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB01301761-01. The TPSA of 70.3 Ų falls within the moderate polarity range, balancing permeability and solubility for AB01301761-01. Following Lipinski's Rule of Five, AB01301761-01 has 0 hydrogen bond donor(s) and 5 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 AB01301761-01?
The CAS number of AB01301761-01 is 903850-97-5.
What is the molecular formula of AB01301761-01?
The molecular formula of AB01301761-01 is C20H20N2O4S.
What is the molecular weight of AB01301761-01?
The molecular weight of AB01301761-01 is 384.11 g/mol.
Where can I buy AB01301761-01?
You can request a quote for AB01301761-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01301761-01?
Yes, KEHONG BIO provides custom synthesis services for AB01301761-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.