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CAS 883107-35-5 N-[2-(4-HYDROXYPHENYL)ETHYL]-METHANESULFONAMIDE molecular structure lightbox
CAS RN: 883107-35-5

N-[2-(4-HYDROXYPHENYL)ETHYL]-METHANESULFONAMIDE

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260222 250mg Out of stock 15 business days Inquiry
  • Product code: starshine_CAS883107-35-5
  • Purity/Analytical Methods: >99.0%
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883107-35-5 / N-[2-(4-hydroxyphenyl)ethyl]methanesulfonamide

Standard CAS: 883107-35-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
883107-35-5
Multi CAS
No
Molecular Formula
C9H13NO3S
Molecular Weight
215.270000
Exact Mass
215.061614
InChI
InChI=1S/C9H13NO3S/c1-14(12,13)10-7-6-8-2-4-9(11)5-3-8/h2-5,10-11H,6-7H2,1H3
InChIKey
ZTPAJHLDDRGNRA-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
6
Fraction Csp3
0.33
Rotatable bonds
4
H-bond acceptors
3
H-bond donors
2
Molar refractivity
54.66
TPSA
66.4

LogP / Solubility

WLOGP
0.48
MLOGP
0.43
XLogP3
0.9
Consensus LogP
0.6
Log S (ESOL)
-1.53
Class (ESOL)
Soluble
Log S (Ali)
-1.67
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.94
Class (SILICOS-IT)
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)
-3.69

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

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