CAS RN: 733038-89-6
Cz-DPS
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20251209 | 25mg / 100mg / 500mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS733038-89-6
- Purity/Analytical Methods: >99.0%
733038-89-6 / 9-[4-(4-carbazol-9-ylphenyl)sulfonylphenyl]carbazole
Basic Information
CAS
733038-89-6
Multi CAS
No
Molecular Formula
C36H24N2O2S
Molecular Weight
548.700000
Exact Mass
548.155849
InChI
InChI=1S/C36H24N2O2S/c39-41(40,27-21-17-25(18-22-27)37-33-13-5-1-9-29(33)30-10-2-6-14-34(30)37)28-23-19-26(20-24-28)38-35-15-7-3-11-31(35)32-12-4-8-16-36(32)38/h1-24H
InChIKey
YDUMUFRPWMBLFH-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
41
Aromatic heavy atom count
38
Rotatable bonds
4
H-bond acceptors
4
Molar refractivity
167.01
TPSA
44
LogP / Solubility
WLOGP
8.71
MLOGP
7.71
XLogP3
8.9
Consensus LogP
8.44
Log S (ESOL)
-9.15
Class (ESOL)
Insoluble
Log S (Ali)
-10.35
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-10.94
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
0.12
Drug-likeness / Medicinal Chemistry
Lipinski
No
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.17
Leadlikeness
No
Synthetic Accessibility
6.5
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