AB00094931-01
TL;DR: AB00094931-01 (CAS 330819-90-4) is a chemical compound with molecular formula C16H16N4O3S and molecular weight 344.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-(12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-yl)furan-2-carbohydrazide
Also Known As: AB00094931-01, N'-(6,6-dimethyl-5,8-dihydropyrano[4,5]thieno[1,2-c]pyrimidin-4-yl)furan-2-carbohydrazide, N'-(6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)-2-furohydrazide, N'-(6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)furan-2-carbohydrazide, N'-(6,6-dimethyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)furan-2-carbohydrazide
| Molecular Formula | C16H16N4O3S |
|---|---|
| Molecular Weight | 344.09 g/mol |
| LogP | 2.8925 |
| Topological Polar Surface Area | 89.28 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 344.0943 |
| Heavy Atoms | 24 |
| Complexity | 901.58325 |
Chemical Identifiers
| CAS Number | 330819-90-4 |
|---|---|
| SMILES | CC1(CC2=C(CO1)SC3=NC=NC(=C23)NNC(=O)C4=CC=CO4)C |
Product Overview
AB00094931-01 (CAS 330819-90-4), with molecular formula C16H16N4O3S and molecular weight 344.09 g/mol. IUPAC: N'-(12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-yl)furan-2-carbohydrazide.
Chemical Property Profile of AB00094931-01
Property Insights of AB00094931-01
The XLogP value of 2.8925 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00094931-01. The TPSA of 89.28 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00094931-01. Following Lipinski's Rule of Five, AB00094931-01 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 AB00094931-01?
The CAS number of AB00094931-01 is 330819-90-4.
What is the molecular formula of AB00094931-01?
The molecular formula of AB00094931-01 is C16H16N4O3S.
What is the molecular weight of AB00094931-01?
The molecular weight of AB00094931-01 is 344.09 g/mol.
Where can I buy AB00094931-01?
You can request a quote for AB00094931-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00094931-01?
Yes, KEHONG BIO provides custom synthesis services for AB00094931-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.