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CAS 611168-24-2 Glycerol phenylbutyrate molecular structure lightbox
CAS RN: 611168-24-2

Glycerol phenylbutyrate

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11 package records11 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250302 100mg In stock Inquiry
Batchno.20250223 10mg In stock Inquiry
Batchno.20250923 250mg In stock Inquiry
Batchno.20250901 500mg In stock Inquiry
Batchno.20250121 50mg In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251209 100mg In stock Shanghai Inquiry
Batchno.20250918 10mg In stock Shanghai Inquiry
Batchno.20250116 1g In stock Shenzhen Inquiry
Batchno.20260208 250mg In stock Shanghai, Shenzhen Inquiry
Batchno.20260317 50mg In stock Shanghai, Shenzhen Inquiry
Batchno.20260622 5mg In stock Shanghai Inquiry
  • Product code: starshine_CAS611168-24-2
  • Purity/Analytical Methods: >99.0%
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611168-24-2 / 2,3-bis(4-phenylbutanoyloxy)propyl 4-phenylbutanoate

Standard CAS: 611168-24-2 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
611168-24-2
Multi CAS
Yes
Molecular Formula
C33H38O6
Molecular Weight
530.600000
Exact Mass
530.266839
InChI
InChI=1S/C33H38O6/c34-31(22-10-19-27-13-4-1-5-14-27)37-25-30(39-33(36)24-12-21-29-17-8-3-9-18-29)26-38-32(35)23-11-20-28-15-6-2-7-16-28/h1-9,13-18,30H,10-12,19-26H2
InChIKey
ZSDBFLMJVAGKOU-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
39
Aromatic heavy atom count
18
Fraction Csp3
0.36
Rotatable bonds
17
H-bond acceptors
6
Molar refractivity
149.94
TPSA
78.9

LogP / Solubility

WLOGP
6.05
MLOGP
5.37
XLogP3
6.7
Consensus LogP
6.04
Log S (ESOL)
-6.16
Class (ESOL)
Insoluble
Log S (Ali)
-8.28
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-10.17
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.66

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
4

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