ASN 13029839
TL;DR: ASN 13029839 (CAS 878729-56-7) is a chemical compound with molecular formula C18H18FN5O3 and molecular weight 371.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(2-fluorophenyl)-2-(3-hydroxypropyl)-4,7-dimethylpurino[7,8-a]imidazole-1,3-dione
Also Known As: ASN 13029839, UPCMLD0ENAT5821747:001, VU0509559-1, 6-(2-fluorophenyl)-2-(3-hydroxypropyl)-4,7-dimethylpurino[7,8-a]imidazole-1,3-dione, F3124-0269
| Molecular Formula | C18H18FN5O3 |
|---|---|
| Molecular Weight | 371.14 g/mol |
| LogP | 0.96852 |
| Topological Polar Surface Area | 86.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 371.13937 |
| Heavy Atoms | 27 |
| Complexity | 1294.5408 |
Chemical Identifiers
| CAS Number | 878729-56-7 |
|---|---|
| SMILES | CC1=CN2C3=C(N=C2N1C4=CC=CC=C4F)N(C(=O)N(C3=O)CCCO)C |
Product Overview
ASN 13029839 (CAS 878729-56-7), with molecular formula C18H18FN5O3 and molecular weight 371.14 g/mol. IUPAC: 6-(2-fluorophenyl)-2-(3-hydroxypropyl)-4,7-dimethylpurino[7,8-a]imidazole-1,3-dione.
Chemical Property Profile of ASN 13029839
Property Insights of ASN 13029839
The XLogP value of 0.96852 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ASN 13029839. The TPSA of 86.46 Ų falls within the moderate polarity range, balancing permeability and solubility for ASN 13029839. Following Lipinski's Rule of Five, ASN 13029839 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 ASN 13029839?
The CAS number of ASN 13029839 is 878729-56-7.
What is the molecular formula of ASN 13029839?
The molecular formula of ASN 13029839 is C18H18FN5O3.
What is the molecular weight of ASN 13029839?
The molecular weight of ASN 13029839 is 371.14 g/mol.
Where can I buy ASN 13029839?
You can request a quote for ASN 13029839 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ASN 13029839?
Yes, KEHONG BIO provides custom synthesis services for ASN 13029839 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.