Benzoic acid, 3,5-diiodo-4-methoxy-, 2-isopropylidenehydrazide
TL;DR: Benzoic acid, 3,5-diiodo-4-methoxy-, 2-isopropylidenehydrazide (CAS 27579-35-7) is a chemical compound with molecular formula C11H12I2N2O2 and molecular weight 457.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-diiodo-4-methoxy-N-(propan-2-ylideneamino)benzamide
Also Known As: 3,5-Diiodo-4-methoxybenzoic acid 2-isopropylidenehydrazide, Benzoic acid, 3,5-diiodo-4-methoxy-, 2-isopropylidenehydrazide, 3,5-diiodo-4-methoxy-n'-(propan-2-ylidene)benzohydrazide, 3,5-diiodo-4-methoxy-N-(propan-2-ylideneamino)benzamide, 3,5-Diiodo-4-methoxy-benzoic acid isopropylidene-hydrazide
| Molecular Formula | C11H12I2N2O2 |
|---|---|
| Molecular Weight | 457.90 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 50.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 457.89883 |
| Heavy Atoms | 17 |
| Complexity | 294.0 |
Chemical Identifiers
| CAS Number | 27579-35-7 |
|---|---|
| SMILES | CC(=NNC(=O)C1=CC(=C(C(=C1)I)OC)I)C |
| InChIKey | YURFZBVWOZUKAX-UHFFFAOYSA-N |
Product Overview
Benzoic acid, 3,5-diiodo-4-methoxy-, 2-isopropylidenehydrazide (CAS 27579-35-7), with molecular formula C11H12I2N2O2 and molecular weight 457.90 g/mol. IUPAC: 3,5-diiodo-4-methoxy-N-(propan-2-ylideneamino)benzamide.
Chemical Property Profile of Benzoic acid, 3,5-diiodo-4-methoxy-, 2-isopropylidenehydrazide
Property Insights of Benzoic acid, 3,5-diiodo-4-methoxy-, 2-isopropylidenehydrazide
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, 3,5-diiodo-4-methoxy-, 2-isopropylidenehydrazide. With a topological polar surface area (TPSA) of 50.7 Ų, Benzoic acid, 3,5-diiodo-4-methoxy-, 2-isopropylidenehydrazide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoic acid, 3,5-diiodo-4-methoxy-, 2-isopropylidenehydrazide has 1 hydrogen bond donor(s) and 3 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 Benzoic acid, 3,5-diiodo-4-methoxy-, 2-isopropylidenehydrazide?
The CAS number of Benzoic acid, 3,5-diiodo-4-methoxy-, 2-isopropylidenehydrazide is 27579-35-7.
What is the molecular formula of Benzoic acid, 3,5-diiodo-4-methoxy-, 2-isopropylidenehydrazide?
The molecular formula of Benzoic acid, 3,5-diiodo-4-methoxy-, 2-isopropylidenehydrazide is C11H12I2N2O2.
What is the molecular weight of Benzoic acid, 3,5-diiodo-4-methoxy-, 2-isopropylidenehydrazide?
The molecular weight of Benzoic acid, 3,5-diiodo-4-methoxy-, 2-isopropylidenehydrazide is 457.90 g/mol.
Where can I buy Benzoic acid, 3,5-diiodo-4-methoxy-, 2-isopropylidenehydrazide?
You can request a quote for Benzoic acid, 3,5-diiodo-4-methoxy-, 2-isopropylidenehydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 3,5-diiodo-4-methoxy-, 2-isopropylidenehydrazide?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 3,5-diiodo-4-methoxy-, 2-isopropylidenehydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.