CAS RN: 1186644-43-8
3-(7-Bromo-9,9-dimethyl-9H-fluoren-2-yl)-9-phenyl-9H-carbazole
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.20260519 | 100mg / 250mg / 1g | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS1186644-43-8
- Purity/Analytical Methods: >99.0%
1186644-43-8 / 3-(7-bromo-9,9-dimethylfluoren-2-yl)-9-phenylcarbazole
3-(7-BROMO-9,9-DIMETHYL-9H-FLUOREN-2-YL)-9-PHENYL-9H-CARBAZOLE | 3-(7-bromo-9,9-dimethylfluoren-2-yl)-9-phenylcarbazole | MFCD19440966
Basic Information
CAS
1186644-43-8
Multi CAS
No
Molecular Formula
C33H24BrN
Molecular Weight
514.500000
Exact Mass
513.109210
SMILES
CC1(C2=C(C=CC(=C2)C3=CC4=C(C=C3)N(C5=CC=CC=C54)C6=CC=CC=C6)C7=C1C=C(C=C7)Br)C
InChI
InChI=1S/C33H24BrN/c1-33(2)29-19-22(12-15-25(29)26-16-14-23(34)20-30(26)33)21-13-17-32-28(18-21)27-10-6-7-11-31(27)35(32)24-8-4-3-5-9-24/h3-20H,1-2H3
InChIKey
LYOIWHQTWCWWFK-UHFFFAOYSA-N
Synonyms
3-(7-BROMO-9,9-DIMETHYL-9H-FLUOREN-2-YL)-9-PHENYL-9H-CARBAZOLE
3-(7-bromo-9,9-dimethylfluoren-2-yl)-9-phenylcarbazole
MFCD19440966
C33H24BrN
SCHEMBL10307240
Computed Properties
Structural Parameters
Heavy atom count
35
Aromatic heavy atom count
31
Fraction Csp3
0.09
Rotatable bonds
2
H-bond acceptors
1
Molar refractivity
151.48
TPSA
4.93
LogP / Solubility
WLOGP
9.52
MLOGP
8.41
XLogP3
9.8
Consensus LogP
9.24
Log S (ESOL)
-9.55
Class (ESOL)
Insoluble
Log S (Ali)
-10.65
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-11.15
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)
0.9
Drug-likeness / Medicinal Chemistry
Lipinski
No
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.17
Leadlikeness
No
Synthetic Accessibility
4.5
Customers Also Viewed
-
3-(4-Bromophenyl)-6,9-diphenyl-9H-carbazole
- CAS RN: 1186644-47-2
- Product Code: starshine_CAS1186644-47-2
- Purity/Analytical method: >99.0%
-
-
4-chloro-3-iodo-1-(propan-2-yl)-1H-pyrazolo[4,3-c]pyridine
- CAS RN: 1186647-71-1
- Product Code: starshine_CAS1186647-71-1
- Purity/Analytical method: >99.0%
-
MK-2 Inhibitor III
- CAS RN: 1186648-22-5
- Product Code: starshine_CAS1186648-22-5
- Purity/Analytical method: >99.0%
-
-
(Z)-5-((5-fluoro-2-oxoindolin-3-ylidene)Methyl)-2,4-diMethyl-1H-pyrrole-3-carboxaMide
- CAS RN: 1186651-51-3
- Product Code: SSC-018561
![CAS 1186647-69-7 4-chloro-3-iodo-1H-pyrazolo[4,3-c]pyridine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1186647-69-7.gif)
![CAS 1186647-71-1 4-chloro-3-iodo-1-(propan-2-yl)-1H-pyrazolo[4,3-c]pyridine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1186647-71-1.gif)
