CAS RN: 1262678-77-2
4,6-Bis(3-(9H -carbazol-9-yl)phenyl)pyrimidine
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.20251030 | 25mg / 100mg / 500mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS1262678-77-2
- Purity/Analytical Methods: >99.0%
1262678-77-2 / 9-[3-[6-(3-carbazol-9-ylphenyl)pyrimidin-4-yl]phenyl]carbazole
Basic Information
CAS
1262678-77-2
Multi CAS
No
Molecular Formula
C40H26N4
Molecular Weight
562.700000
Exact Mass
562.215747
SMILES
C1=CC=C2C(=C1)C3=CC=CC=C3N2C4=CC=CC(=C4)C5=CC(=NC=N5)C6=CC(=CC=C6)N7C8=CC=CC=C8C9=CC=CC=C97
InChI
InChI=1S/C40H26N4/c1-5-19-37-31(15-1)32-16-2-6-20-38(32)43(37)29-13-9-11-27(23-29)35-25-36(42-26-41-35)28-12-10-14-30(24-28)44-39-21-7-3-17-33(39)34-18-4-8-22-40(34)44/h1-26H
InChIKey
LNNMKLNCLINVKV-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
44
Aromatic heavy atom count
44
Rotatable bonds
4
H-bond acceptors
4
Molar refractivity
181.58
TPSA
35.64
LogP / Solubility
WLOGP
10
MLOGP
8.85
XLogP3
9.7
Consensus LogP
9.52
Log S (ESOL)
-10.11
Class (ESOL)
Insoluble
Log S (Ali)
-11.4
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-12.1
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)
0.95
Drug-likeness / Medicinal Chemistry
Lipinski
No
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.17
Leadlikeness
No
Synthetic Accessibility
7
Safety & Transport
Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement Codes
P264, P270, P301+P317, P330, and P501
Customers Also Viewed
-
-
4,9-Dibromo-6,7-diphenyl-[1,2,5]thiadiazolo[3,4-g]quinoxaline
- CAS RN: 1262727-09-2
- Product Code: SSC-033232
-
OVA Peptide (257-264) TFA
- CAS RN: 1262751-08-5
- Product Code: starshine_CAS1262751-08-5
- Purity/Analytical method: >99.0%
-
Carbamic acid, N-[[(1S,2S)-2-(hydroxymethyl)cyclopropyl]methyl]-, 1,1-dimethylethyl ester
- CAS RN: 1262755-28-1
- Product Code: SSC-033236
-
5,5-dimethyl-2-(3-methylbutanoyl)cyclohexane-1,3-dione
- CAS RN: 1262769-43-6
- Product Code: starshine_CAS1262769-43-6
- Purity/Analytical method: >99.0%
-
![CAS 1262727-09-2 4,9-Dibromo-6,7-diphenyl-[1,2,5]thiadiazolo[3,4-g]quinoxaline molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1262727-09-2.gif)
![CAS 1262755-28-1 Carbamic acid, N-[[(1S,2S)-2-(hydroxymethyl)cyclopropyl]methyl]-, 1,1-dimethylethyl ester molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1262755-28-1.gif)
