AB01275846-01
TL;DR: AB01275846-01 (CAS 899994-20-8) is a chemical compound with molecular formula C22H23N3O3S and molecular weight 409.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-yl)-2-spiro[1H-quinazoline-2,1'-cyclohexane]-4-ylsulfanylacetamide
Also Known As: AB01275846-01, AB01275846-04, F3165-0960, N-(1,3-benzodioxol-5-yl)-2-spiro[1H-quinazoline-2,1'-cyclohexane]-4-ylsulfanylacetamide, N-(2H-1,3-benzodioxol-5-yl)-2-{1'H-spiro[cyclohexane-1,2'-quinazoline]sulfanyl}acetamide
| Molecular Formula | C22H23N3O3S |
|---|---|
| Molecular Weight | 409.15 g/mol |
| LogP | 4.6197 |
| Topological Polar Surface Area | 71.95 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 409.14603 |
| Heavy Atoms | 29 |
| Complexity | 969.5249 |
Chemical Identifiers
| CAS Number | 899994-20-8 |
|---|---|
| SMILES | C1CCC2(CC1)NC3=CC=CC=C3C(=N2)SCC(=O)NC4=CC5=C(C=C4)OCO5 |
Product Overview
AB01275846-01 (CAS 899994-20-8), with molecular formula C22H23N3O3S and molecular weight 409.15 g/mol. IUPAC: N-(1,3-benzodioxol-5-yl)-2-spiro[1H-quinazoline-2,1'-cyclohexane]-4-ylsulfanylacetamide.
Chemical Property Profile of AB01275846-01
Property Insights of AB01275846-01
The XLogP value of 4.6197 indicates that AB01275846-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.95 Ų falls within the moderate polarity range, balancing permeability and solubility for AB01275846-01. Following Lipinski's Rule of Five, AB01275846-01 has 2 hydrogen bond donor(s) and 6 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 AB01275846-01?
The CAS number of AB01275846-01 is 899994-20-8.
What is the molecular formula of AB01275846-01?
The molecular formula of AB01275846-01 is C22H23N3O3S.
What is the molecular weight of AB01275846-01?
The molecular weight of AB01275846-01 is 409.15 g/mol.
Where can I buy AB01275846-01?
You can request a quote for AB01275846-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01275846-01?
Yes, KEHONG BIO provides custom synthesis services for AB01275846-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.