BAS 01312882
TL;DR: BAS 01312882 (CAS 337487-73-7) is a chemical compound with molecular formula C28H38N2OS and molecular weight 450.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-cyclohexyl-2-pentylsulfanylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one
Also Known As: BAS 01312882, 3-cyclohexyl-2-(pentylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one, 3-cyclohexyl-2-(pentylthio)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one, 3-cyclohexyl-2-pentylsulfanylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one, 3-cyclohexyl-2-pentylthiospiro[3,5,6-trihydrobenzo[h]quinazoline-5,1'-cyclohex ane]-4-one
| Molecular Formula | C28H38N2OS |
|---|---|
| Molecular Weight | 450.27 g/mol |
| LogP | 7.4558 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 450.27048 |
| Heavy Atoms | 32 |
| Complexity | 998.97736 |
Chemical Identifiers
| CAS Number | 337487-73-7 |
|---|---|
| SMILES | CCCCCSC1=NC2=C(C(=O)N1C3CCCCC3)C4(CCCCC4)CC5=CC=CC=C52 |
Product Overview
BAS 01312882 (CAS 337487-73-7), with molecular formula C28H38N2OS and molecular weight 450.27 g/mol. IUPAC: 3-cyclohexyl-2-pentylsulfanylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one.
Chemical Property Profile of BAS 01312882
Property Insights of BAS 01312882
The XLogP value of 7.4558 indicates that BAS 01312882 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.89 Ų, BAS 01312882 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 01312882 has 0 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 BAS 01312882?
The CAS number of BAS 01312882 is 337487-73-7.
What is the molecular formula of BAS 01312882?
The molecular formula of BAS 01312882 is C28H38N2OS.
What is the molecular weight of BAS 01312882?
The molecular weight of BAS 01312882 is 450.27 g/mol.
Where can I buy BAS 01312882?
You can request a quote for BAS 01312882 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01312882?
Yes, KEHONG BIO provides custom synthesis services for BAS 01312882 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.