ChemDiv1_028897
TL;DR: ChemDiv1_028897 (CAS 302903-57-7) is a chemical compound with molecular formula C23H24N4 and molecular weight 356.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-6-tert-butyl-4-phenyl-4a,5,6,7-tetrahydro-4H-naphthalene-1,3,3-tricarbonitrile
Also Known As: ChemDiv1_028897, MixCom3_000047, 2-amino-6-tert-butyl-4-phenyl-4a,5,6,7-tetrahydro-4H-naphthalene-1,3,3-tricarbonitrile, A0565/0026111, 2-amino-6-tert-butyl-4-phenyl-4a,5,6,7-tetrahydro-1,3,3(4H)-naphthalenetricarbonitrile
| Molecular Formula | C23H24N4 |
|---|---|
| Molecular Weight | 356.20 g/mol |
| LogP | 4.55244 |
| Topological Polar Surface Area | 97.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 356.2001 |
| Heavy Atoms | 27 |
| Complexity | 911.81116 |
Chemical Identifiers
| CAS Number | 302903-57-7 |
|---|---|
| SMILES | CC(C)(C)C1CC=C2C(C1)C(C(C(=C2C#N)N)(C#N)C#N)C3=CC=CC=C3 |
Product Overview
ChemDiv1_028897 (CAS 302903-57-7), with molecular formula C23H24N4 and molecular weight 356.20 g/mol. IUPAC: 2-amino-6-tert-butyl-4-phenyl-4a,5,6,7-tetrahydro-4H-naphthalene-1,3,3-tricarbonitrile.
Chemical Property Profile of ChemDiv1_028897
Property Insights of ChemDiv1_028897
The XLogP value of 4.55244 indicates that ChemDiv1_028897 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.39 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_028897. Following Lipinski's Rule of Five, ChemDiv1_028897 has 1 hydrogen bond donor(s) and 4 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 ChemDiv1_028897?
The CAS number of ChemDiv1_028897 is 302903-57-7.
What is the molecular formula of ChemDiv1_028897?
The molecular formula of ChemDiv1_028897 is C23H24N4.
What is the molecular weight of ChemDiv1_028897?
The molecular weight of ChemDiv1_028897 is 356.20 g/mol.
Where can I buy ChemDiv1_028897?
You can request a quote for ChemDiv1_028897 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_028897?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_028897 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.