CAS RN: 1425544-56-4

Phenol, 2-(9H-carbazol-9-yl)-

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250609 100mg / 1g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS1425544-56-4
  • Purity/Analytical Methods: >99.0%
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1425544-56-4 / 2-carbazol-9-ylphenol

Standard CAS: 1425544-56-4 Multi CAS: No

Basic Information

CAS
1425544-56-4
Multi CAS
No
Molecular Formula
C18H13NO
Molecular Weight
259.300000
Exact Mass
259.099714
SMILES
C1=CC=C2C(=C1)C3=CC=CC=C3N2C4=CC=CC=C4O
InChI
InChI=1S/C18H13NO/c20-18-12-6-5-11-17(18)19-15-9-3-1-7-13(15)14-8-2-4-10-16(14)19/h1-12,20H
InChIKey
BNWYJOAUDHQFBK-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
20
Aromatic heavy atom count
19
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
82.45
TPSA
25.16

LogP / Solubility

WLOGP
4.49
MLOGP
3.96
XLogP3
4.6
Consensus LogP
4.35
Log S (ESOL)
-4.91
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.93
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.19
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
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.11

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

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