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CAS 886366-26-3 4-(1-FMOC-PIPERIDIN-3-YL)-BUTYRIC ACID molecular structure lightbox
CAS RN: 886366-26-3

4-(1-FMOC-PIPERIDIN-3-YL)-BUTYRIC ACID

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260607 100mg / 1g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS886366-26-3
  • Purity/Analytical Methods: >99.0%
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886366-26-3 / 4-[1-(9H-fluoren-9-ylmethoxycarbonyl)piperidin-3-yl]butanoic acid

Standard CAS: 886366-26-3 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
886366-26-3
Multi CAS
No
Molecular Formula
C24H27NO4
Molecular Weight
393.500000
Exact Mass
393.194008
InChI
InChI=1S/C24H27NO4/c26-23(27)13-5-7-17-8-6-14-25(15-17)24(28)29-16-22-20-11-3-1-9-18(20)19-10-2-4-12-21(19)22/h1-4,9-12,17,22H,5-8,13-16H2,(H,26,27)
InChIKey
UIDAXORFQBOKLU-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
29
Aromatic heavy atom count
12
Fraction Csp3
0.42
Rotatable bonds
6
H-bond acceptors
3
H-bond donors
1
Molar refractivity
110.85
TPSA
66.84

LogP / Solubility

WLOGP
4.9
MLOGP
4.34
XLogP3
4.2
Consensus LogP
4.48
Log S (ESOL)
-5.28
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.33
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.01
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.64

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3.5

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