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CAS 32527-55-2 Tiaramide molecular structure lightbox
CAS RN: 32527-55-2

Tiaramide

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250420 100mg / 250mg / 1g Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS32527-55-2
  • Purity/Analytical Methods: >99.0%
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32527-55-2 / 5-chloro-3-[2-[4-(2-hydroxyethyl)piperazin-1-yl]-2-oxoethyl]-1,3-benzothiazol-2-one

Standard CAS: 32527-55-2 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
32527-55-2
Multi CAS
Yes
Molecular Formula
C15H18CLN3O3S
Molecular Weight
355.800000
Exact Mass
355.075740
InChI
InChI=1S/C15H18ClN3O3S/c16-11-1-2-13-12(9-11)19(15(22)23-13)10-14(21)18-5-3-17(4-6-18)7-8-20/h1-2,9,20H,3-8,10H2
InChIKey
HTJXMOGUGMSZOG-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
23
Aromatic heavy atom count
9
Fraction Csp3
0.47
Rotatable bonds
4
H-bond acceptors
6
H-bond donors
1
Molar refractivity
91.2
TPSA
65.78

LogP / Solubility

WLOGP
0.85
MLOGP
0.77
XLogP3
1
Consensus LogP
0.87
Log S (ESOL)
-2.61
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.09
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.16
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.29

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5

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