N-(2-propyltetrazol-5-yl)-1,3-benzodioxole-5-carboxamide
TL;DR: N-(2-propyltetrazol-5-yl)-1,3-benzodioxole-5-carboxamide (CAS 847677-73-0) is a chemical compound with molecular formula C12H13N5O3 and molecular weight 275.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-propyltetrazol-5-yl)-1,3-benzodioxole-5-carboxamide
Also Known As: N-(2-propyltetrazol-5-yl)-1,3-benzodioxole-5-carboxamide, N-(2-propyl-2H-tetrazol-5-yl)-1,3-benzodioxole-5-carboxamide, N-(2-Propyl-2H-tetrazol-5-yl)-2H-1,3-benzodioxole-5-carboxamide, N-(2-propyl-2H-tetrazol-5-yl)benzo[d][1,3]dioxole-5-carboxamide, Benzo[1,3]dioxole-5-carboxylic acid (2-propyl-2H-tetrazol-5-yl)-amide
| Molecular Formula | C12H13N5O3 |
|---|---|
| Molecular Weight | 275.10 g/mol |
| LogP | 1.0641 |
| Topological Polar Surface Area | 91.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 275.10184 |
| Heavy Atoms | 20 |
| Complexity | 639.7731 |
Chemical Identifiers
| CAS Number | 847677-73-0 |
|---|---|
| SMILES | CCCN1N=C(N=N1)NC(=O)C2=CC3=C(C=C2)OCO3 |
Product Overview
N-(2-propyltetrazol-5-yl)-1,3-benzodioxole-5-carboxamide (CAS 847677-73-0), with molecular formula C12H13N5O3 and molecular weight 275.10 g/mol. IUPAC: N-(2-propyltetrazol-5-yl)-1,3-benzodioxole-5-carboxamide.
Chemical Property Profile of N-(2-propyltetrazol-5-yl)-1,3-benzodioxole-5-carboxamide
Property Insights of N-(2-propyltetrazol-5-yl)-1,3-benzodioxole-5-carboxamide
The XLogP value of 1.0641 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-propyltetrazol-5-yl)-1,3-benzodioxole-5-carboxamide. The TPSA of 91.16 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-propyltetrazol-5-yl)-1,3-benzodioxole-5-carboxamide. Following Lipinski's Rule of Five, N-(2-propyltetrazol-5-yl)-1,3-benzodioxole-5-carboxamide 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 N-(2-propyltetrazol-5-yl)-1,3-benzodioxole-5-carboxamide?
The CAS number of N-(2-propyltetrazol-5-yl)-1,3-benzodioxole-5-carboxamide is 847677-73-0.
What is the molecular formula of N-(2-propyltetrazol-5-yl)-1,3-benzodioxole-5-carboxamide?
The molecular formula of N-(2-propyltetrazol-5-yl)-1,3-benzodioxole-5-carboxamide is C12H13N5O3.
What is the molecular weight of N-(2-propyltetrazol-5-yl)-1,3-benzodioxole-5-carboxamide?
The molecular weight of N-(2-propyltetrazol-5-yl)-1,3-benzodioxole-5-carboxamide is 275.10 g/mol.
Where can I buy N-(2-propyltetrazol-5-yl)-1,3-benzodioxole-5-carboxamide?
You can request a quote for N-(2-propyltetrazol-5-yl)-1,3-benzodioxole-5-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-propyltetrazol-5-yl)-1,3-benzodioxole-5-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-propyltetrazol-5-yl)-1,3-benzodioxole-5-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.