N'~1~,N'~3~-di(tert-butyl)isophthalohydrazide
TL;DR: N'~1~,N'~3~-di(tert-butyl)isophthalohydrazide (CAS 55296-27-0) is a chemical compound with molecular formula C16H26N4O2 and molecular weight 306.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-N',3-N'-ditert-butylbenzene-1,3-dicarbohydrazide
Also Known As: N'~1~,N'~3~-di(tert-butyl)isophthalohydrazide, AO-359/40796540, 1-N',3-N'-ditert-butylbenzene-1,3-dicarbohydrazide, 1-N/',3-N/'-Ditert-butylbenzene-1,3-dicarbohydrazide, N-[(tert-butyl)amino](3-{N-[(tert-butyl)amino]carbamoyl}phenyl)carboxamide
| Molecular Formula | C16H26N4O2 |
|---|---|
| Molecular Weight | 306.21 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 82.3 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 306.20557 |
| Heavy Atoms | 22 |
| Complexity | 360.0 |
Chemical Identifiers
| CAS Number | 55296-27-0 |
|---|---|
| SMILES | CC(C)(C)NNC(=O)C1=CC(=CC=C1)C(=O)NNC(C)(C)C |
| InChIKey | VHMDEDSVCTUCFD-UHFFFAOYSA-N |
Product Overview
N'~1~,N'~3~-di(tert-butyl)isophthalohydrazide (CAS 55296-27-0), with molecular formula C16H26N4O2 and molecular weight 306.21 g/mol. IUPAC: 1-N',3-N'-ditert-butylbenzene-1,3-dicarbohydrazide.
Chemical Property Profile of N'~1~,N'~3~-di(tert-butyl)isophthalohydrazide
Property Insights of N'~1~,N'~3~-di(tert-butyl)isophthalohydrazide
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N'~1~,N'~3~-di(tert-butyl)isophthalohydrazide. The TPSA of 82.3 Ų falls within the moderate polarity range, balancing permeability and solubility for N'~1~,N'~3~-di(tert-butyl)isophthalohydrazide. Following Lipinski's Rule of Five, N'~1~,N'~3~-di(tert-butyl)isophthalohydrazide has 4 hydrogen bond donor(s) and 4 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'~1~,N'~3~-di(tert-butyl)isophthalohydrazide?
The CAS number of N'~1~,N'~3~-di(tert-butyl)isophthalohydrazide is 55296-27-0.
What is the molecular formula of N'~1~,N'~3~-di(tert-butyl)isophthalohydrazide?
The molecular formula of N'~1~,N'~3~-di(tert-butyl)isophthalohydrazide is C16H26N4O2.
What is the molecular weight of N'~1~,N'~3~-di(tert-butyl)isophthalohydrazide?
The molecular weight of N'~1~,N'~3~-di(tert-butyl)isophthalohydrazide is 306.21 g/mol.
Where can I buy N'~1~,N'~3~-di(tert-butyl)isophthalohydrazide?
You can request a quote for N'~1~,N'~3~-di(tert-butyl)isophthalohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N'~1~,N'~3~-di(tert-butyl)isophthalohydrazide?
Yes, KEHONG BIO provides custom synthesis services for N'~1~,N'~3~-di(tert-butyl)isophthalohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.