ChemDiv3_004008
TL;DR: ChemDiv3_004008 (CAS 591764-52-2) is a chemical compound with molecular formula C19H19N3O4S and molecular weight 385.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-methoxyphenyl)-2-[[5-[(4-methoxyphenyl)methyl]-1,3,4-oxadiazol-2-yl]sulfanyl]acetamide
Also Known As: ChemDiv3_004008, IDI1_021918, BRD-K80823156-001-01-3, 2-{[5-(4-methoxybenzyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide, N-(4-METHOXYPHENYL)-2-({5-[(4-METHOXYPHENYL)METHYL]-1,3,4-OXADIAZOL-2-YL}SULFANYL)ACETAMIDE
| Molecular Formula | C19H19N3O4S |
|---|---|
| Molecular Weight | 385.11 g/mol |
| LogP | 3.4084 |
| Topological Polar Surface Area | 86.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 385.10962 |
| Heavy Atoms | 27 |
| Complexity | 878.7302 |
Chemical Identifiers
| CAS Number | 591764-52-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)CC2=NN=C(O2)SCC(=O)NC3=CC=C(C=C3)OC |
Product Overview
ChemDiv3_004008 (CAS 591764-52-2), with molecular formula C19H19N3O4S and molecular weight 385.11 g/mol. IUPAC: N-(4-methoxyphenyl)-2-[[5-[(4-methoxyphenyl)methyl]-1,3,4-oxadiazol-2-yl]sulfanyl]acetamide.
Chemical Property Profile of ChemDiv3_004008
Property Insights of ChemDiv3_004008
The XLogP value of 3.4084 indicates that ChemDiv3_004008 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.48 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv3_004008. Following Lipinski's Rule of Five, ChemDiv3_004008 has 1 hydrogen bond donor(s) and 7 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 ChemDiv3_004008?
The CAS number of ChemDiv3_004008 is 591764-52-2.
What is the molecular formula of ChemDiv3_004008?
The molecular formula of ChemDiv3_004008 is C19H19N3O4S.
What is the molecular weight of ChemDiv3_004008?
The molecular weight of ChemDiv3_004008 is 385.11 g/mol.
Where can I buy ChemDiv3_004008?
You can request a quote for ChemDiv3_004008 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_004008?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_004008 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.