![4,5-dimethyl-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiophene-3-carboxamide structure](/static/products/492/492437-91-9.png)
4,5-dimethyl-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiophene-3-carboxamide
TL;DR: 4,5-dimethyl-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiophene-3-carboxamide (CAS 492437-91-9) is a chemical compound with molecular formula C15H13N3O5S and molecular weight 347.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-dimethyl-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiophene-3-carboxamide
Also Known As: 4,5-dimethyl-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiophene-3-carboxamide, N'-({6-nitro-1,3-benzodioxol-5-yl}methylene)-4,5-dimethyl-3-thiophenecarbohydrazide, 4,5-dimethyl-N'-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylidene]thiophene-3-carbohydrazide, N-[(1E)-2-(6-nitro(2H-benzo[d]1,3-dioxolen-5-yl))-1-azavinyl](4,5-dimethyl(3-t hienyl))carboxamide
| Molecular Formula | C15H13N3O5S |
|---|---|
| Molecular Weight | 347.06 g/mol |
| LogP | 2.76574 |
| Topological Polar Surface Area | 103.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 347.0576 |
| Heavy Atoms | 24 |
| Complexity | 859.03467 |
Chemical Identifiers
| CAS Number | 492437-91-9 |
|---|---|
| SMILES | CC1=C(SC=C1C(=O)N/N=C/C2=CC3=C(C=C2[N+](=O)[O-])OCO3)C |
Product Overview
4,5-dimethyl-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiophene-3-carboxamide (CAS 492437-91-9), with molecular formula C15H13N3O5S and molecular weight 347.06 g/mol. IUPAC: 4,5-dimethyl-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiophene-3-carboxamide.
Chemical Property Profile of 4,5-dimethyl-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiophene-3-carboxamide
Property Insights of 4,5-dimethyl-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiophene-3-carboxamide
The XLogP value of 2.76574 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,5-dimethyl-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiophene-3-carboxamide. The TPSA of 103.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,5-dimethyl-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiophene-3-carboxamide. Following Lipinski's Rule of Five, 4,5-dimethyl-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiophene-3-carboxamide has 1 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 4,5-dimethyl-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiophene-3-carboxamide?
The CAS number of 4,5-dimethyl-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiophene-3-carboxamide is 492437-91-9.
What is the molecular formula of 4,5-dimethyl-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiophene-3-carboxamide?
The molecular formula of 4,5-dimethyl-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiophene-3-carboxamide is C15H13N3O5S.
What is the molecular weight of 4,5-dimethyl-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiophene-3-carboxamide?
The molecular weight of 4,5-dimethyl-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiophene-3-carboxamide is 347.06 g/mol.
Where can I buy 4,5-dimethyl-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiophene-3-carboxamide?
You can request a quote for 4,5-dimethyl-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiophene-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5-dimethyl-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiophene-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 4,5-dimethyl-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]thiophene-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.