N,N'-1,2,5-oxadiazole-3,4-diylbis(3-iodo-4-methylbenzamide)
TL;DR: N,N'-1,2,5-oxadiazole-3,4-diylbis(3-iodo-4-methylbenzamide) (CAS 512796-85-9) is a chemical compound with molecular formula C18H14I2N4O3 and molecular weight 587.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-iodo-N-[4-[(3-iodo-4-methylbenzoyl)amino]-1,2,5-oxadiazol-3-yl]-4-methylbenzamide
Also Known As: N,N'-1,2,5-oxadiazole-3,4-diylbis(3-iodo-4-methylbenzamide), AN-329/41967551, 3-iodo-N-[4-[(3-iodo-4-methylbenzoyl)amino]-1,2,5-oxadiazol-3-yl]-4-methylbenzamide, 3-iodo-N-{4-[(3-iodo-4-methylbenzoyl)amino]-1,2,5-oxadiazol-3-yl}-4-methylbenzamide
| Molecular Formula | C18H14I2N4O3 |
|---|---|
| Molecular Weight | 587.92 g/mol |
| LogP | 4.40024 |
| Topological Polar Surface Area | 97.12 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 587.9155 |
| Heavy Atoms | 27 |
| Complexity | 953.1962 |
Chemical Identifiers
| CAS Number | 512796-85-9 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)NC2=NON=C2NC(=O)C3=CC(=C(C=C3)C)I)I |
Product Overview
N,N'-1,2,5-oxadiazole-3,4-diylbis(3-iodo-4-methylbenzamide) (CAS 512796-85-9), with molecular formula C18H14I2N4O3 and molecular weight 587.92 g/mol. IUPAC: 3-iodo-N-[4-[(3-iodo-4-methylbenzoyl)amino]-1,2,5-oxadiazol-3-yl]-4-methylbenzamide.
Chemical Property Profile of N,N'-1,2,5-oxadiazole-3,4-diylbis(3-iodo-4-methylbenzamide)
Property Insights of N,N'-1,2,5-oxadiazole-3,4-diylbis(3-iodo-4-methylbenzamide)
The XLogP value of 4.40024 indicates that N,N'-1,2,5-oxadiazole-3,4-diylbis(3-iodo-4-methylbenzamide) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.12 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N'-1,2,5-oxadiazole-3,4-diylbis(3-iodo-4-methylbenzamide). Following Lipinski's Rule of Five, N,N'-1,2,5-oxadiazole-3,4-diylbis(3-iodo-4-methylbenzamide) has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N,N'-1,2,5-oxadiazole-3,4-diylbis(3-iodo-4-methylbenzamide)?
The CAS number of N,N'-1,2,5-oxadiazole-3,4-diylbis(3-iodo-4-methylbenzamide) is 512796-85-9.
What is the molecular formula of N,N'-1,2,5-oxadiazole-3,4-diylbis(3-iodo-4-methylbenzamide)?
The molecular formula of N,N'-1,2,5-oxadiazole-3,4-diylbis(3-iodo-4-methylbenzamide) is C18H14I2N4O3.
What is the molecular weight of N,N'-1,2,5-oxadiazole-3,4-diylbis(3-iodo-4-methylbenzamide)?
The molecular weight of N,N'-1,2,5-oxadiazole-3,4-diylbis(3-iodo-4-methylbenzamide) is 587.92 g/mol.
Where can I buy N,N'-1,2,5-oxadiazole-3,4-diylbis(3-iodo-4-methylbenzamide)?
You can request a quote for N,N'-1,2,5-oxadiazole-3,4-diylbis(3-iodo-4-methylbenzamide) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N'-1,2,5-oxadiazole-3,4-diylbis(3-iodo-4-methylbenzamide)?
Yes, KEHONG BIO provides custom synthesis services for N,N'-1,2,5-oxadiazole-3,4-diylbis(3-iodo-4-methylbenzamide) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.