![6,6-dimethyl-3-phenyl-2-[2-(propan-2-ylidene)hydrazinyl]-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one structure](/static/products/339/339347-40-9.png)
6,6-dimethyl-3-phenyl-2-[2-(propan-2-ylidene)hydrazinyl]-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
TL;DR: 6,6-dimethyl-3-phenyl-2-[2-(propan-2-ylidene)hydrazinyl]-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one (CAS 339347-40-9) is a chemical compound with molecular formula C20H22N4O2S and molecular weight 382.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
12,12-dimethyl-4-phenyl-5-(2-propan-2-ylidenehydrazinyl)-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one
Also Known As: 6,6-dimethyl-3-phenyl-2-[2-(propan-2-ylidene)hydrazinyl]-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one, 6,6-dimethyl-3-phenyl-2-(2-(propan-2-ylidene)hydrazinyl)-5,6-dihydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4(8H)-one
| Molecular Formula | C20H22N4O2S |
|---|---|
| Molecular Weight | 382.15 g/mol |
| LogP | 4.1062 |
| Topological Polar Surface Area | 68.51 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 382.14636 |
| Heavy Atoms | 27 |
| Complexity | 1092.6074 |
Chemical Identifiers
| CAS Number | 339347-40-9 |
|---|---|
| SMILES | CC(=NNC1=NC2=C(C3=C(S2)COC(C3)(C)C)C(=O)N1C4=CC=CC=C4)C |
Product Overview
6,6-dimethyl-3-phenyl-2-[2-(propan-2-ylidene)hydrazinyl]-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one (CAS 339347-40-9), with molecular formula C20H22N4O2S and molecular weight 382.15 g/mol. IUPAC: 12,12-dimethyl-4-phenyl-5-(2-propan-2-ylidenehydrazinyl)-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one.
Chemical Property Profile of 6,6-dimethyl-3-phenyl-2-[2-(propan-2-ylidene)hydrazinyl]-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Property Insights of 6,6-dimethyl-3-phenyl-2-[2-(propan-2-ylidene)hydrazinyl]-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
The XLogP value of 4.1062 indicates that 6,6-dimethyl-3-phenyl-2-[2-(propan-2-ylidene)hydrazinyl]-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.51 Ų falls within the moderate polarity range, balancing permeability and solubility for 6,6-dimethyl-3-phenyl-2-[2-(propan-2-ylidene)hydrazinyl]-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one. Following Lipinski's Rule of Five, 6,6-dimethyl-3-phenyl-2-[2-(propan-2-ylidene)hydrazinyl]-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one 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 6,6-dimethyl-3-phenyl-2-[2-(propan-2-ylidene)hydrazinyl]-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one?
The CAS number of 6,6-dimethyl-3-phenyl-2-[2-(propan-2-ylidene)hydrazinyl]-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one is 339347-40-9.
What is the molecular formula of 6,6-dimethyl-3-phenyl-2-[2-(propan-2-ylidene)hydrazinyl]-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one?
The molecular formula of 6,6-dimethyl-3-phenyl-2-[2-(propan-2-ylidene)hydrazinyl]-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one is C20H22N4O2S.
What is the molecular weight of 6,6-dimethyl-3-phenyl-2-[2-(propan-2-ylidene)hydrazinyl]-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one?
The molecular weight of 6,6-dimethyl-3-phenyl-2-[2-(propan-2-ylidene)hydrazinyl]-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one is 382.15 g/mol.
Where can I buy 6,6-dimethyl-3-phenyl-2-[2-(propan-2-ylidene)hydrazinyl]-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one?
You can request a quote for 6,6-dimethyl-3-phenyl-2-[2-(propan-2-ylidene)hydrazinyl]-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,6-dimethyl-3-phenyl-2-[2-(propan-2-ylidene)hydrazinyl]-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 6,6-dimethyl-3-phenyl-2-[2-(propan-2-ylidene)hydrazinyl]-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.