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CAS 38241-28-0 Zinterol hydrochloride molecular structure lightbox
CAS RN: 38241-28-0

Zinterol hydrochloride

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260627 5mg Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS38241-28-0
  • Purity/Analytical Methods: >99.0%
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38241-28-0 / N-[2-hydroxy-5-[1-hydroxy-2-[(2-methyl-1-phenylpropan-2-yl)amino]ethyl]phenyl]methanesulfonamide;hydrochloride

Standard CAS: 38241-28-0 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
38241-28-0
Multi CAS
Yes
Molecular Formula
C19H27CLN2O4S
Molecular Weight
414.900000
Exact Mass
414.138006
InChI
InChI=1S/C19H26N2O4S.ClH/c1-19(2,12-14-7-5-4-6-8-14)20-13-18(23)15-9-10-17(22)16(11-15)21-26(3,24)25;/h4-11,18,20-23H,12-13H2,1-3H3;1H
InChIKey
LVNUBJDWJFOMKH-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
27
Aromatic heavy atom count
12
Fraction Csp3
0.37
Rotatable bonds
8
H-bond acceptors
5
H-bond donors
4
Molar refractivity
111.01
TPSA
98.66

LogP / Solubility

WLOGP
2.83
MLOGP
2.52
XLogP3
2.83
Consensus LogP
2.73
Log S (ESOL)
-4
Class (ESOL)
Poorly soluble
Log S (Ali)
-5.01
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.67
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
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-3.24

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3

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