BAS 12663429
TL;DR: BAS 12663429 (CAS 878411-73-5) is a chemical compound with molecular formula C18H23N5O4 and molecular weight 373.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-(4,7,8-trimethyl-1,3-dioxo-6-prop-2-enylpurino[7,8-a]imidazol-2-yl)propanoate
Also Known As: BAS 12663429, ethyl 3-(4,7,8-trimethyl-1,3-dioxo-6-prop-2-enylpurino[7,8-a]imidazol-2-yl)propanoate, F2583-0722, ethyl 3-(8-allyl-1,6,7-trimethyl-2,4-dioxo-1H-imidazo[2,1-f]purin-3(2H,4H,8H)-yl)propanoate, ethyl 3-(1,6,7-trimethyl-2,4-dioxo-8-prop-2-enyl-1,3,5-trihydro-4-imidazolino[ 1,2-h]purin-3-yl)propanoate
| Molecular Formula | C18H23N5O4 |
|---|---|
| Molecular Weight | 373.18 g/mol |
| LogP | 0.90544 |
| Topological Polar Surface Area | 92.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 373.17502 |
| Heavy Atoms | 27 |
| Complexity | 1174.9774 |
Chemical Identifiers
| CAS Number | 878411-73-5 |
|---|---|
| SMILES | CCOC(=O)CCN1C(=O)C2=C(N=C3N2C(=C(N3CC=C)C)C)N(C1=O)C |
Product Overview
BAS 12663429 (CAS 878411-73-5), with molecular formula C18H23N5O4 and molecular weight 373.18 g/mol. IUPAC: ethyl 3-(4,7,8-trimethyl-1,3-dioxo-6-prop-2-enylpurino[7,8-a]imidazol-2-yl)propanoate.
Chemical Property Profile of BAS 12663429
Property Insights of BAS 12663429
The XLogP value of 0.90544 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 12663429. The TPSA of 92.53 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 12663429. Following Lipinski's Rule of Five, BAS 12663429 has 0 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 BAS 12663429?
The CAS number of BAS 12663429 is 878411-73-5.
What is the molecular formula of BAS 12663429?
The molecular formula of BAS 12663429 is C18H23N5O4.
What is the molecular weight of BAS 12663429?
The molecular weight of BAS 12663429 is 373.18 g/mol.
Where can I buy BAS 12663429?
You can request a quote for BAS 12663429 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 12663429?
Yes, KEHONG BIO provides custom synthesis services for BAS 12663429 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.