BAS 00319167
TL;DR: BAS 00319167 (CAS 321968-75-6) is a chemical compound with molecular formula C25H26IN7O4 and molecular weight 615.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(E)-[(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)hydrazinylidene]methyl]phenyl] 3-iodobenzoate
Also Known As: BAS 00319167, (E)-4-((2-(4,6-dimorpholino-1,3,5-triazin-2-yl)hydrazono)methyl)phenyl 3-iodobenzoate, F0037-9343, 4-[(1E)-{2-[4,6-BIS(MORPHOLIN-4-YL)-1,3,5-TRIAZIN-2-YL]HYDRAZIN-1-YLIDENE}METHYL]PHENYL 3-IODOBENZOATE, [4-[(E)-[(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)hydrazinylidene]methyl]phenyl] 3-iodobenzoate
| Molecular Formula | C25H26IN7O4 |
|---|---|
| Molecular Weight | 615.11 g/mol |
| LogP | 2.8146 |
| Topological Polar Surface Area | 114.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 7 |
| Exact Mass | 615.1091 |
| Heavy Atoms | 37 |
| Complexity | 1209.7925 |
Chemical Identifiers
| CAS Number | 321968-75-6 |
|---|---|
| SMILES | C1COCCN1C2=NC(=NC(=N2)N/N=C/C3=CC=C(C=C3)OC(=O)C4=CC(=CC=C4)I)N5CCOCC5 |
Product Overview
BAS 00319167 (CAS 321968-75-6), with molecular formula C25H26IN7O4 and molecular weight 615.11 g/mol. IUPAC: [4-[(E)-[(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)hydrazinylidene]methyl]phenyl] 3-iodobenzoate.
Chemical Property Profile of BAS 00319167
Property Insights of BAS 00319167
The XLogP value of 2.8146 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00319167. The TPSA of 114.3 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00319167. Following Lipinski's Rule of Five, BAS 00319167 has 1 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00319167?
The CAS number of BAS 00319167 is 321968-75-6.
What is the molecular formula of BAS 00319167?
The molecular formula of BAS 00319167 is C25H26IN7O4.
What is the molecular weight of BAS 00319167?
The molecular weight of BAS 00319167 is 615.11 g/mol.
Where can I buy BAS 00319167?
You can request a quote for BAS 00319167 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00319167?
Yes, KEHONG BIO provides custom synthesis services for BAS 00319167 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.