C20H21FN4O
TL;DR: C20H21FN4O (CAS 1009231-73-5) is a chemical compound with molecular formula C20H21FN4O and molecular weight 352.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-fluoro-3-[(E)-(2,4,6-trimethylcyclohex-3-en-1-yl)methylideneamino]-5H-pyrimido[5,4-b]indol-4-one
Also Known As: (E)-8-fluoro-3-(((2,4,6-trimethylcyclohex-3-en-1-yl)methylene)amino)-3H-pyrimido[5,4-b]indol-4(5H)-one, 8-fluoro-3-{[(E)-(2,4,6-trimethylcyclohex-3-en-1-yl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
| Molecular Formula | C20H21FN4O |
|---|---|
| Molecular Weight | 352.17 g/mol |
| LogP | 4.0892 |
| Topological Polar Surface Area | 63.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 352.16995 |
| Heavy Atoms | 26 |
| Complexity | 1108.1351 |
Chemical Identifiers
| CAS Number | 1009231-73-5 |
|---|---|
| SMILES | CC1CC(=CC(C1/C=N/N2C=NC3=C(C2=O)NC4=C3C=C(C=C4)F)C)C |
Product Overview
C20H21FN4O (CAS 1009231-73-5), with molecular formula C20H21FN4O and molecular weight 352.17 g/mol. IUPAC: 8-fluoro-3-[(E)-(2,4,6-trimethylcyclohex-3-en-1-yl)methylideneamino]-5H-pyrimido[5,4-b]indol-4-one.
Chemical Property Profile of C20H21FN4O
Property Insights of C20H21FN4O
The XLogP value of 4.0892 indicates that C20H21FN4O is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.04 Ų falls within the moderate polarity range, balancing permeability and solubility for C20H21FN4O. Following Lipinski's Rule of Five, C20H21FN4O has 1 hydrogen bond donor(s) and 3 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 C20H21FN4O?
The CAS number of C20H21FN4O is 1009231-73-5.
What is the molecular formula of C20H21FN4O?
The molecular formula of C20H21FN4O is C20H21FN4O.
What is the molecular weight of C20H21FN4O?
The molecular weight of C20H21FN4O is 352.17 g/mol.
Where can I buy C20H21FN4O?
You can request a quote for C20H21FN4O directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C20H21FN4O?
Yes, KEHONG BIO provides custom synthesis services for C20H21FN4O and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.