BAS 00608834
TL;DR: BAS 00608834 (CAS 302802-33-1) is a chemical compound with molecular formula C18H18N4O and molecular weight 306.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
12-methylspiro[12,14,15,17-tetrazatetracyclo[8.7.0.02,7.013,17]heptadeca-1(10),2,4,6,13,15-hexaene-9,1'-cyclopentane]-11-one
Also Known As: BAS 00608834, 4-methyl-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclopentan]-5(7H)-one
| Molecular Formula | C18H18N4O |
|---|---|
| Molecular Weight | 306.15 g/mol |
| LogP | 2.4629 |
| Topological Polar Surface Area | 52.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 306.14807 |
| Heavy Atoms | 23 |
| Complexity | 991.9145 |
Chemical Identifiers
| CAS Number | 302802-33-1 |
|---|---|
| SMILES | CN1C(=O)C2=C(C3=CC=CC=C3CC24CCCC4)N5C1=NN=C5 |
Product Overview
BAS 00608834 (CAS 302802-33-1), with molecular formula C18H18N4O and molecular weight 306.15 g/mol. IUPAC: 12-methylspiro[12,14,15,17-tetrazatetracyclo[8.7.0.02,7.013,17]heptadeca-1(10),2,4,6,13,15-hexaene-9,1'-cyclopentane]-11-one.
Chemical Property Profile of BAS 00608834
Property Insights of BAS 00608834
The XLogP value of 2.4629 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00608834. With a topological polar surface area (TPSA) of 52.19 Ų, BAS 00608834 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00608834 has 0 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 BAS 00608834?
The CAS number of BAS 00608834 is 302802-33-1.
What is the molecular formula of BAS 00608834?
The molecular formula of BAS 00608834 is C18H18N4O.
What is the molecular weight of BAS 00608834?
The molecular weight of BAS 00608834 is 306.15 g/mol.
Where can I buy BAS 00608834?
You can request a quote for BAS 00608834 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00608834?
Yes, KEHONG BIO provides custom synthesis services for BAS 00608834 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.