BAS 00312819
TL;DR: BAS 00312819 (CAS 305332-05-2) is a chemical compound with molecular formula C33H48N4 and molecular weight 500.39 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
16-(octadecylamino)-1,8-diazatetracyclo[7.7.0.02,7.011,15]hexadeca-2,4,6,8,10,15-hexaene-10-carbonitrile
Also Known As: BAS 00312819, 11-(octadecylamino)-2,3-dihydro-1H-cyclopenta[4,5]pyrido[1,2-a]benzimidazole-4-carbonitrile, 11-(octadecylamino)-2,3-dihydro-1H-benzo[4,5]imidazo[1,2-a]cyclopenta[d]pyridine-4-carbonitrile
| Molecular Formula | C33H48N4 |
|---|---|
| Molecular Weight | 500.39 g/mol |
| LogP | 9.52128 |
| Topological Polar Surface Area | 53.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 18 |
| Exact Mass | 500.3879 |
| Heavy Atoms | 37 |
| Complexity | 1152.7802 |
Chemical Identifiers
| CAS Number | 305332-05-2 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCCNC1=C2CCCC2=C(C3=NC4=CC=CC=C4N13)C#N |
Product Overview
BAS 00312819 (CAS 305332-05-2), with molecular formula C33H48N4 and molecular weight 500.39 g/mol. IUPAC: 16-(octadecylamino)-1,8-diazatetracyclo[7.7.0.02,7.011,15]hexadeca-2,4,6,8,10,15-hexaene-10-carbonitrile.
Chemical Property Profile of BAS 00312819
Property Insights of BAS 00312819
The XLogP value of 9.52128 indicates that BAS 00312819 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.12 Ų, BAS 00312819 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00312819 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00312819?
The CAS number of BAS 00312819 is 305332-05-2.
What is the molecular formula of BAS 00312819?
The molecular formula of BAS 00312819 is C33H48N4.
What is the molecular weight of BAS 00312819?
The molecular weight of BAS 00312819 is 500.39 g/mol.
Where can I buy BAS 00312819?
You can request a quote for BAS 00312819 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00312819?
Yes, KEHONG BIO provides custom synthesis services for BAS 00312819 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.