NCI60_040275
TL;DR: NCI60_040275 (CAS 222715-80-2) is a chemical compound with molecular formula C33H39N7 and molecular weight 533.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-propylbenzimidazol-2-yl)-N,N-bis[(1-propylbenzimidazol-2-yl)methyl]methanamine
Also Known As: NCI60_040275, tris((1-propyl-1H-benzo[d]imidazol-2-yl)methyl)amine, J1.100.828C, Tris(1-propyl-1H-benzimidazole-2-ylmethyl)amine, tris[(1-propyl-1H-1,3-benzodiazol-2-yl)methyl]amine
| Molecular Formula | C33H39N7 |
|---|---|
| Molecular Weight | 533.33 g/mol |
| LogP | 5.9 |
| Topological Polar Surface Area | 56.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 533.3267 |
| Heavy Atoms | 40 |
| Complexity | 680.0 |
Chemical Identifiers
| CAS Number | 222715-80-2 |
|---|---|
| SMILES | CCCN1C2=CC=CC=C2N=C1CN(CC3=NC4=CC=CC=C4N3CCC)CC5=NC6=CC=CC=C6N5CCC |
| InChIKey | KIHQMDIBTPBWQM-UHFFFAOYSA-N |
Product Overview
NCI60_040275 (CAS 222715-80-2), with molecular formula C33H39N7 and molecular weight 533.33 g/mol. IUPAC: 1-(1-propylbenzimidazol-2-yl)-N,N-bis[(1-propylbenzimidazol-2-yl)methyl]methanamine.
Chemical Property Profile of NCI60_040275
Property Insights of NCI60_040275
The XLogP value of 5.9 indicates that NCI60_040275 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.7 Ų, NCI60_040275 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, NCI60_040275 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of NCI60_040275?
The CAS number of NCI60_040275 is 222715-80-2.
What is the molecular formula of NCI60_040275?
The molecular formula of NCI60_040275 is C33H39N7.
What is the molecular weight of NCI60_040275?
The molecular weight of NCI60_040275 is 533.33 g/mol.
Where can I buy NCI60_040275?
You can request a quote for NCI60_040275 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for NCI60_040275?
Yes, KEHONG BIO provides custom synthesis services for NCI60_040275 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.