Cambridge id 5916475
TL;DR: Cambridge id 5916475 (CAS 332849-68-0) is a chemical compound with molecular formula C27H29N3O2S and molecular weight 459.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-[(4-methylphenyl)methyl]-4-oxospiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-2-yl]sulfanylacetamide
Also Known As: CBKinase1_001089, CBKinase1_013489, BAS 01836191, 2-((3-(4-methylbenzyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)thio)acetamide, 2-[3-[(4-methylphenyl)methyl]-4-oxospiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-2-yl]sulfanylacetamide
| Molecular Formula | C27H29N3O2S |
|---|---|
| Molecular Weight | 459.20 g/mol |
| LogP | 4.60242 |
| Topological Polar Surface Area | 77.98 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 459.19806 |
| Heavy Atoms | 33 |
| Complexity | 1257.3484 |
Chemical Identifiers
| CAS Number | 332849-68-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CN2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N=C2SCC(=O)N |
Product Overview
Cambridge id 5916475 (CAS 332849-68-0), with molecular formula C27H29N3O2S and molecular weight 459.20 g/mol. IUPAC: 2-[3-[(4-methylphenyl)methyl]-4-oxospiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-2-yl]sulfanylacetamide.
Chemical Property Profile of Cambridge id 5916475
Property Insights of Cambridge id 5916475
The XLogP value of 4.60242 indicates that Cambridge id 5916475 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.98 Ų falls within the moderate polarity range, balancing permeability and solubility for Cambridge id 5916475. Following Lipinski's Rule of Five, Cambridge id 5916475 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Cambridge id 5916475?
The CAS number of Cambridge id 5916475 is 332849-68-0.
What is the molecular formula of Cambridge id 5916475?
The molecular formula of Cambridge id 5916475 is C27H29N3O2S.
What is the molecular weight of Cambridge id 5916475?
The molecular weight of Cambridge id 5916475 is 459.20 g/mol.
Where can I buy Cambridge id 5916475?
You can request a quote for Cambridge id 5916475 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cambridge id 5916475?
Yes, KEHONG BIO provides custom synthesis services for Cambridge id 5916475 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.