(2E)-N'-(3-methyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)-3-phenylprop-2-enehydrazide
TL;DR: (2E)-N'-(3-methyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)-3-phenylprop-2-enehydrazide (CAS 317844-66-9) is a chemical compound with molecular formula C20H20N4O2S and molecular weight 380.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N'-(3-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)-3-phenylprop-2-enehydrazide
Also Known As: (2E)-N'-(3-methyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)-3-phenylprop-2-enehydrazide, (E)-N'-(3-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)-3-phenylprop-2-enehydrazide, N'-(3-methyl-4-oxo-3,4,5,6,7,8-hexahydrobenzo[4,5]thieno[2,3-d]pyrimidin-2-yl)cinnamohydrazide
| Molecular Formula | C20H20N4O2S |
|---|---|
| Molecular Weight | 380.13 g/mol |
| LogP | 3.0303 |
| Topological Polar Surface Area | 76.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 380.1307 |
| Heavy Atoms | 27 |
| Complexity | 1082.795 |
Chemical Identifiers
| CAS Number | 317844-66-9 |
|---|---|
| SMILES | CN1C(=O)C2=C(N=C1NNC(=O)/C=C/C3=CC=CC=C3)SC4=C2CCCC4 |
Product Overview
(2E)-N'-(3-methyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)-3-phenylprop-2-enehydrazide (CAS 317844-66-9), with molecular formula C20H20N4O2S and molecular weight 380.13 g/mol. IUPAC: (E)-N'-(3-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)-3-phenylprop-2-enehydrazide.
Chemical Property Profile of (2E)-N'-(3-methyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)-3-phenylprop-2-enehydrazide
Property Insights of (2E)-N'-(3-methyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)-3-phenylprop-2-enehydrazide
The XLogP value of 3.0303 indicates that (2E)-N'-(3-methyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)-3-phenylprop-2-enehydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.02 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-N'-(3-methyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)-3-phenylprop-2-enehydrazide. Following Lipinski's Rule of Five, (2E)-N'-(3-methyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)-3-phenylprop-2-enehydrazide has 2 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 (2E)-N'-(3-methyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)-3-phenylprop-2-enehydrazide?
The CAS number of (2E)-N'-(3-methyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)-3-phenylprop-2-enehydrazide is 317844-66-9.
What is the molecular formula of (2E)-N'-(3-methyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)-3-phenylprop-2-enehydrazide?
The molecular formula of (2E)-N'-(3-methyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)-3-phenylprop-2-enehydrazide is C20H20N4O2S.
What is the molecular weight of (2E)-N'-(3-methyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)-3-phenylprop-2-enehydrazide?
The molecular weight of (2E)-N'-(3-methyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)-3-phenylprop-2-enehydrazide is 380.13 g/mol.
Where can I buy (2E)-N'-(3-methyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)-3-phenylprop-2-enehydrazide?
You can request a quote for (2E)-N'-(3-methyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)-3-phenylprop-2-enehydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-N'-(3-methyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)-3-phenylprop-2-enehydrazide?
Yes, KEHONG BIO provides custom synthesis services for (2E)-N'-(3-methyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)-3-phenylprop-2-enehydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.