ChemDiv2_007093
TL;DR: ChemDiv2_007093 (CAS 902444-28-4) is a chemical compound with molecular formula C23H23N7O and molecular weight 413.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(9-methyl-2,4,5,7,8,10-hexazatetracyclo[10.4.0.02,6.07,11]hexadeca-1(16),3,5,8,10,12,14-heptaen-3-yl)-N-(2-phenylethyl)butanamide
Also Known As: ChemDiv2_007093, IDI1_005808, F6548-1799, 4-(10-methylbis[1,2,4]triazolo[1,5-c:4',3'-a]quinazolin-3-yl)-N-(2-phenylethyl)butanamide, 4-(9-methyl-2,4,5,7,8,10-hexazatetracyclo[10.4.0.02,6.07,11]hexadeca-1(16),3,5,8,10,12,14-heptaen-3-yl)-N-(2-phenylethyl)butanamide
| Molecular Formula | C23H23N7O |
|---|---|
| Molecular Weight | 413.20 g/mol |
| LogP | 2.91522 |
| Topological Polar Surface Area | 89.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 413.1964 |
| Heavy Atoms | 31 |
| Complexity | 1370.7668 |
Chemical Identifiers
| CAS Number | 902444-28-4 |
|---|---|
| SMILES | CC1=NN2C(=N1)C3=CC=CC=C3N4C2=NN=C4CCCC(=O)NCCC5=CC=CC=C5 |
Product Overview
ChemDiv2_007093 (CAS 902444-28-4), with molecular formula C23H23N7O and molecular weight 413.20 g/mol. IUPAC: 4-(9-methyl-2,4,5,7,8,10-hexazatetracyclo[10.4.0.02,6.07,11]hexadeca-1(16),3,5,8,10,12,14-heptaen-3-yl)-N-(2-phenylethyl)butanamide.
Chemical Property Profile of ChemDiv2_007093
Property Insights of ChemDiv2_007093
The XLogP value of 2.91522 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv2_007093. The TPSA of 89.48 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv2_007093. Following Lipinski's Rule of Five, ChemDiv2_007093 has 1 hydrogen bond donor(s) and 5 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 ChemDiv2_007093?
The CAS number of ChemDiv2_007093 is 902444-28-4.
What is the molecular formula of ChemDiv2_007093?
The molecular formula of ChemDiv2_007093 is C23H23N7O.
What is the molecular weight of ChemDiv2_007093?
The molecular weight of ChemDiv2_007093 is 413.20 g/mol.
Where can I buy ChemDiv2_007093?
You can request a quote for ChemDiv2_007093 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv2_007093?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv2_007093 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.