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CAS 67722-65-0 Ethanone, 1,1′-(6,7,9,10,17,18,20,21-octahydrodibenzo[b,k][1,4,7,10,13,16]hexaoxacyclooctadecin-2,14-diyl)bis- molecular structure lightbox
CAS RN: 67722-65-0

Ethanone, 1,1′-(6,7,9,10,17,18,20,21-octahydrodibenzo[b,k][1,4,7,10,13,16]hexaoxacyclooctadecin-2,14-diyl)bis-

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4 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260225 1g In stock Shenzhen, Chengdu Inquiry
Batchno.20250303 250mg In stock Shenzhen, Wuhan, Chengdu Inquiry
Batchno.20251027 250mg / 1g / 5g Out of stock 5-7 business days Inquiry
Batchno.20250930 5g In stock Shenzhen Inquiry
  • Product code: starshine_CAS67722-65-0
  • Purity/Analytical Methods: >99.0%
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67722-65-0 / 1-(25-acetyl-2,5,8,15,18,21-hexaoxatricyclo[20.4.0.09,14]hexacosa-1(22),9(14),10,12,23,25-hexaen-11-yl)ethanone

Standard CAS: 67722-65-0 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
67722-65-0
Multi CAS
No
Molecular Formula
C24H28O8
Molecular Weight
444.500000
Exact Mass
444.178418
InChI
InChI=1S/C24H28O8/c1-17(25)19-3-5-21-23(15-19)31-13-9-28-10-14-32-24-16-20(18(2)26)4-6-22(24)30-12-8-27-7-11-29-21/h3-6,15-16H,7-14H2,1-2H3
InChIKey
DSUIUXGYGAPDAA-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
32
Aromatic heavy atom count
12
Fraction Csp3
0.42
Rotatable bonds
2
H-bond acceptors
8
Molar refractivity
116.51
TPSA
89.52

LogP / Solubility

WLOGP
3.35
MLOGP
2.98
XLogP3
1.6
Consensus LogP
2.64
Log S (ESOL)
-4.85
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.63
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.57
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-3.05

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
4

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