BAS 09896410
TL;DR: BAS 09896410 (CAS 876721-75-4) 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.
3-(2-methoxyethyl)-7-methyl-1,3,10-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-2(6),7,9,11,13,15-hexaene-8-carbonitrile
Also Known As: BAS 09896410, UPCMLD0ENAT5742640:001, F1727-0091, 1-(2-methoxyethyl)-4-methyl-2,3-dihydro-1H-pyrrolo[3',2':5,6]pyrido[1,2-a]benzimidazole-5-carbonitrile, 3-(2-methoxyethyl)-7-methyl-1,3,10-triazatetracyclo[7.7.0.0^{2,6}.0^{11,16}]hexadeca-2(6),7,9,11,13,15-hexaene-8-carbonitrile
| Molecular Formula | C18H18N4O |
|---|---|
| Molecular Weight | 306.15 g/mol |
| LogP | 2.6765 |
| Topological Polar Surface Area | 53.56 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 306.14807 |
| Heavy Atoms | 23 |
| Complexity | 951.1956 |
Chemical Identifiers
| CAS Number | 876721-75-4 |
|---|---|
| SMILES | CC1=C(C2=NC3=CC=CC=C3N2C4=C1CCN4CCOC)C#N |
Product Overview
BAS 09896410 (CAS 876721-75-4), with molecular formula C18H18N4O and molecular weight 306.15 g/mol. IUPAC: 3-(2-methoxyethyl)-7-methyl-1,3,10-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-2(6),7,9,11,13,15-hexaene-8-carbonitrile.
Chemical Property Profile of BAS 09896410
Property Insights of BAS 09896410
The XLogP value of 2.6765 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 09896410. With a topological polar surface area (TPSA) of 53.56 Ų, BAS 09896410 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 09896410 has 0 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 BAS 09896410?
The CAS number of BAS 09896410 is 876721-75-4.
What is the molecular formula of BAS 09896410?
The molecular formula of BAS 09896410 is C18H18N4O.
What is the molecular weight of BAS 09896410?
The molecular weight of BAS 09896410 is 306.15 g/mol.
Where can I buy BAS 09896410?
You can request a quote for BAS 09896410 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 09896410?
Yes, KEHONG BIO provides custom synthesis services for BAS 09896410 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.