C18H18FN5O
TL;DR: C18H18FN5O (CAS 903584-40-7) is a chemical compound with molecular formula C18H18FN5O and molecular weight 339.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(4-fluorophenyl)-11,12-dimethyl-3,5,6,8,10-pentazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]propan-1-ol
Also Known As: 3-(2-(4-fluorophenyl)-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-7-yl)propan-1-ol, 3-[2-(4-FLUOROPHENYL)-8,9-DIMETHYL-7H-PYRROLO[3,2-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDIN-7-YL]-1-PROPANOL, 3-[2-(4-fluorophenyl)-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-7-yl]propan-1-ol
| Molecular Formula | C18H18FN5O |
|---|---|
| Molecular Weight | 339.15 g/mol |
| LogP | 2.88434 |
| Topological Polar Surface Area | 68.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 339.14954 |
| Heavy Atoms | 25 |
| Complexity | 1064.8931 |
Chemical Identifiers
| CAS Number | 903584-40-7 |
|---|---|
| SMILES | CC1=C(N(C2=C1C3=NC(=NN3C=N2)C4=CC=C(C=C4)F)CCCO)C |
Product Overview
C18H18FN5O (CAS 903584-40-7), with molecular formula C18H18FN5O and molecular weight 339.15 g/mol. IUPAC: 3-[4-(4-fluorophenyl)-11,12-dimethyl-3,5,6,8,10-pentazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]propan-1-ol.
Chemical Property Profile of C18H18FN5O
Property Insights of C18H18FN5O
The XLogP value of 2.88434 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C18H18FN5O. The TPSA of 68.24 Ų falls within the moderate polarity range, balancing permeability and solubility for C18H18FN5O. Following Lipinski's Rule of Five, C18H18FN5O 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 C18H18FN5O?
The CAS number of C18H18FN5O is 903584-40-7.
What is the molecular formula of C18H18FN5O?
The molecular formula of C18H18FN5O is C18H18FN5O.
What is the molecular weight of C18H18FN5O?
The molecular weight of C18H18FN5O is 339.15 g/mol.
Where can I buy C18H18FN5O?
You can request a quote for C18H18FN5O directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C18H18FN5O?
Yes, KEHONG BIO provides custom synthesis services for C18H18FN5O and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.