Benzoic acid, 3,5-dichloro-4-methoxy-, 2-isobutylidenehydrazide
TL;DR: Benzoic acid, 3,5-dichloro-4-methoxy-, 2-isobutylidenehydrazide (CAS 23959-55-9) is a chemical compound with molecular formula C12H14Cl2N2O2 and molecular weight 288.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dichloro-4-methoxy-N-[(E)-2-methylpropylideneamino]benzamide
Also Known As: 3,5-Dichloro-4-methoxybenzoic acid 2-isobutylidenehydrazide, Benzoic acid, 3,5-dichloro-4-methoxy-, 2-isobutylidenehydrazide, RefChem:1079038, BRN 3084879
| Molecular Formula | C12H14Cl2N2O2 |
|---|---|
| Molecular Weight | 288.04 g/mol |
| LogP | 3.3736 |
| Topological Polar Surface Area | 50.69 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 288.04324 |
| Heavy Atoms | 18 |
| Complexity | 450.14038 |
Chemical Identifiers
| CAS Number | 23959-55-9 |
|---|---|
| SMILES | CC(C)/C=N/NC(=O)C1=CC(=C(C(=C1)Cl)OC)Cl |
Product Overview
Benzoic acid, 3,5-dichloro-4-methoxy-, 2-isobutylidenehydrazide (CAS 23959-55-9), with molecular formula C12H14Cl2N2O2 and molecular weight 288.04 g/mol. IUPAC: 3,5-dichloro-4-methoxy-N-[(E)-2-methylpropylideneamino]benzamide.
Chemical Property Profile of Benzoic acid, 3,5-dichloro-4-methoxy-, 2-isobutylidenehydrazide
Property Insights of Benzoic acid, 3,5-dichloro-4-methoxy-, 2-isobutylidenehydrazide
The XLogP value of 3.3736 indicates that Benzoic acid, 3,5-dichloro-4-methoxy-, 2-isobutylidenehydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.69 Ų, Benzoic acid, 3,5-dichloro-4-methoxy-, 2-isobutylidenehydrazide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoic acid, 3,5-dichloro-4-methoxy-, 2-isobutylidenehydrazide 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-dichloro-4-methoxy-, 2-isobutylidenehydrazide?
The CAS number of Benzoic acid, 3,5-dichloro-4-methoxy-, 2-isobutylidenehydrazide is 23959-55-9.
What is the molecular formula of Benzoic acid, 3,5-dichloro-4-methoxy-, 2-isobutylidenehydrazide?
The molecular formula of Benzoic acid, 3,5-dichloro-4-methoxy-, 2-isobutylidenehydrazide is C12H14Cl2N2O2.
What is the molecular weight of Benzoic acid, 3,5-dichloro-4-methoxy-, 2-isobutylidenehydrazide?
The molecular weight of Benzoic acid, 3,5-dichloro-4-methoxy-, 2-isobutylidenehydrazide is 288.04 g/mol.
Where can I buy Benzoic acid, 3,5-dichloro-4-methoxy-, 2-isobutylidenehydrazide?
You can request a quote for Benzoic acid, 3,5-dichloro-4-methoxy-, 2-isobutylidenehydrazide 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-dichloro-4-methoxy-, 2-isobutylidenehydrazide?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 3,5-dichloro-4-methoxy-, 2-isobutylidenehydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.