C30H33BrN4O
TL;DR: C30H33BrN4O (CAS 372171-82-9) is a chemical compound with molecular formula C30H33BrN4O and molecular weight 544.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2E)-2-[(4-bromophenyl)methylidene]hydrazinyl]-3-cyclohexylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one
Also Known As: (E)-2-(2-(4-bromobenzylidene)hydrazinyl)-3-cyclohexyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one, 2-[(2E)-2-(4-bromobenzylidene)hydrazinyl]-3-cyclohexyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
| Molecular Formula | C30H33BrN4O |
|---|---|
| Molecular Weight | 544.18 g/mol |
| LogP | 7.382 |
| Topological Polar Surface Area | 59.28 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 544.1838 |
| Heavy Atoms | 36 |
| Complexity | 1332.0452 |
Chemical Identifiers
| CAS Number | 372171-82-9 |
|---|---|
| SMILES | C1CCC(CC1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N=C2N/N=C/C6=CC=C(C=C6)Br |
Product Overview
C30H33BrN4O (CAS 372171-82-9), with molecular formula C30H33BrN4O and molecular weight 544.18 g/mol. IUPAC: 2-[(2E)-2-[(4-bromophenyl)methylidene]hydrazinyl]-3-cyclohexylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one.
Chemical Property Profile of C30H33BrN4O
Property Insights of C30H33BrN4O
The XLogP value of 7.382 indicates that C30H33BrN4O is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.28 Ų, C30H33BrN4O exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C30H33BrN4O has 1 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 C30H33BrN4O?
The CAS number of C30H33BrN4O is 372171-82-9.
What is the molecular formula of C30H33BrN4O?
The molecular formula of C30H33BrN4O is C30H33BrN4O.
What is the molecular weight of C30H33BrN4O?
The molecular weight of C30H33BrN4O is 544.18 g/mol.
Where can I buy C30H33BrN4O?
You can request a quote for C30H33BrN4O directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C30H33BrN4O?
Yes, KEHONG BIO provides custom synthesis services for C30H33BrN4O and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.