AB00098598-01
TL;DR: AB00098598-01 (CAS 329213-50-5) is a chemical compound with molecular formula C17H22N4O3S and molecular weight 362.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
12,12-dimethyl-8-morpholin-4-yl-11-oxa-5-thia-7-azatricyclo[7.4.0.02,6]trideca-1,3,6,8-tetraene-4-carbohydrazide
Also Known As: AB00098598-01, 8,8-dimethyl-5-morpholino-8,9-dihydro-6H-pyrano[4,3-d]thieno[2,3-b]pyridine-2-carbohydrazide, 8,8-dimethyl-5-(4-morpholinyl)-8,9-dihydro-6H-pyrano[4,3-d]thieno[2,3-b]pyridine-2-carbohydrazide, 8,8-dimethyl-5-(morpholin-4-yl)-8,9-dihydro-6H-pyrano[4,3-d]thieno[2,3-b]pyridine-2-carbohydrazide, 8,8-dimethyl-5-morpholin-4-yl-8,9-dihydro-6H-pyrano[4,3-d]thiopheno[2,3-b]pyri dine-2-carbohydrazide
| Molecular Formula | C17H22N4O3S |
|---|---|
| Molecular Weight | 362.14 g/mol |
| LogP | 1.5877 |
| Topological Polar Surface Area | 89.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 362.14127 |
| Heavy Atoms | 25 |
| Complexity | 826.8976 |
Chemical Identifiers
| CAS Number | 329213-50-5 |
|---|---|
| SMILES | CC1(CC2=C3C=C(SC3=NC(=C2CO1)N4CCOCC4)C(=O)NN)C |
Product Overview
AB00098598-01 (CAS 329213-50-5), with molecular formula C17H22N4O3S and molecular weight 362.14 g/mol. IUPAC: 12,12-dimethyl-8-morpholin-4-yl-11-oxa-5-thia-7-azatricyclo[7.4.0.02,6]trideca-1,3,6,8-tetraene-4-carbohydrazide.
Chemical Property Profile of AB00098598-01
Property Insights of AB00098598-01
The XLogP value of 1.5877 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00098598-01. The TPSA of 89.71 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00098598-01. Following Lipinski's Rule of Five, AB00098598-01 has 2 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 AB00098598-01?
The CAS number of AB00098598-01 is 329213-50-5.
What is the molecular formula of AB00098598-01?
The molecular formula of AB00098598-01 is C17H22N4O3S.
What is the molecular weight of AB00098598-01?
The molecular weight of AB00098598-01 is 362.14 g/mol.
Where can I buy AB00098598-01?
You can request a quote for AB00098598-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00098598-01?
Yes, KEHONG BIO provides custom synthesis services for AB00098598-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.