C29H33BrN4O
TL;DR: C29H33BrN4O (CAS 488803-86-7) is a chemical compound with molecular formula C29H33BrN4O and molecular weight 532.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(Z)-(3-bromophenyl)methylideneamino]-2-(12-cyclohexyl-1,4-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-9(16),10(15),11,13-tetraen-4-yl)acetamide
Also Known As: (Z)-N'-(3-bromobenzylidene)-2-(8-cyclohexyl-3a,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazol-3(2H)-yl)acetohydrazide, N'-[(Z)-(3-bromophenyl)methylidene]-2-(8-cyclohexyl-1,2,3a,4,5,6-hexahydro-3H-pyrazino[3,2,1-jk]carbazol-3-yl)acetohydrazide
| Molecular Formula | C29H33BrN4O |
|---|---|
| Molecular Weight | 532.18 g/mol |
| LogP | 6.2948 |
| Topological Polar Surface Area | 49.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 532.1838 |
| Heavy Atoms | 35 |
| Complexity | 1273.1676 |
Chemical Identifiers
| CAS Number | 488803-86-7 |
|---|---|
| SMILES | C1CCC(CC1)C2=CC3=C(C=C2)N4CCN(C5C4=C3CCC5)CC(=O)N/N=C\C6=CC(=CC=C6)Br |
Product Overview
C29H33BrN4O (CAS 488803-86-7), with molecular formula C29H33BrN4O and molecular weight 532.18 g/mol. IUPAC: N-[(Z)-(3-bromophenyl)methylideneamino]-2-(12-cyclohexyl-1,4-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-9(16),10(15),11,13-tetraen-4-yl)acetamide.
Chemical Property Profile of C29H33BrN4O
Property Insights of C29H33BrN4O
The XLogP value of 6.2948 indicates that C29H33BrN4O is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.63 Ų, C29H33BrN4O exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C29H33BrN4O 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 C29H33BrN4O?
The CAS number of C29H33BrN4O is 488803-86-7.
What is the molecular formula of C29H33BrN4O?
The molecular formula of C29H33BrN4O is C29H33BrN4O.
What is the molecular weight of C29H33BrN4O?
The molecular weight of C29H33BrN4O is 532.18 g/mol.
Where can I buy C29H33BrN4O?
You can request a quote for C29H33BrN4O directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C29H33BrN4O?
Yes, KEHONG BIO provides custom synthesis services for C29H33BrN4O and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.