AF-399/42176792
TL;DR: AF-399/42176792 (CAS 575460-39-8) is a chemical compound with molecular formula C23H22BrN3O and molecular weight 435.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-bromophenyl)-12,15,15-trimethyl-3,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-2,4,6,8,10-pentaene-1-carboxamide
Also Known As: AF-399/42176792, N-(2-Bromophenyl)-12,15,15-trimethyl-3,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-2,4,6,8,10-pentaene-1-carboxamide, N-(2-bromophenyl)-4,11,11-trimethyl-3,4-dihydro-1,4-methanophenazine-1(2H)-carboxamide, (1R,4S)-N-(2-bromophenyl)-4,11,11-trimethyl-1,2,3,4-tetrahydro-1,4-methanophenazine-1-carboxamide, N-(2-bromophenyl)(12,15,15-trimethyl-3,10-diazatetracyclo[10.2.1.0<2,11>.0<4,9 >]pentadeca-2(11),3,5,7,9-pentaenyl)carboxamide
| Molecular Formula | C23H22BrN3O |
|---|---|
| Molecular Weight | 435.09 g/mol |
| LogP | 5.3601 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 435.09464 |
| Heavy Atoms | 28 |
| Complexity | 1141.6505 |
Chemical Identifiers
| CAS Number | 575460-39-8 |
|---|---|
| SMILES | CC1(C2(CCC1(C3=NC4=CC=CC=C4N=C32)C(=O)NC5=CC=CC=C5Br)C)C |
Product Overview
AF-399/42176792 (CAS 575460-39-8), with molecular formula C23H22BrN3O and molecular weight 435.09 g/mol. IUPAC: N-(2-bromophenyl)-12,15,15-trimethyl-3,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-2,4,6,8,10-pentaene-1-carboxamide.
Chemical Property Profile of AF-399/42176792
Property Insights of AF-399/42176792
The XLogP value of 5.3601 indicates that AF-399/42176792 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.88 Ų, AF-399/42176792 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AF-399/42176792 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 AF-399/42176792?
The CAS number of AF-399/42176792 is 575460-39-8.
What is the molecular formula of AF-399/42176792?
The molecular formula of AF-399/42176792 is C23H22BrN3O.
What is the molecular weight of AF-399/42176792?
The molecular weight of AF-399/42176792 is 435.09 g/mol.
Where can I buy AF-399/42176792?
You can request a quote for AF-399/42176792 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/42176792?
Yes, KEHONG BIO provides custom synthesis services for AF-399/42176792 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.