CAS RN: 1141017-77-7
3-Bromo-9-(3,5-dimethylphenyl)-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.20250427 | 200mg | Out of stock | 30 business days | Inquiry |
- Product code: SSC-014000
Historical Factory Record
Historical Supply Reference
This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.
- Pack sizes on record: 1g
- Available purity: ≥95%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | ≥95% | 0 Out of Stock | Hong Kong | Inquiry |
1141017-77-7 / 3-bromo-9-(3,5-dimethylphenyl)carbazole
3-Bromo-9-(3,5-dimethylphenyl)-9H-carbazole | RefChem:499152 | 834-501-8
Basic Information
CAS
1141017-77-7
Multi CAS
No
Molecular Formula
C20H16BrN
Molecular Weight
350.300000
Exact Mass
349.046610
SMILES
CC1=CC(=CC(=C1)N2C3=C(C=C(C=C3)Br)C4=CC=CC=C42)C
InChI
InChI=1S/C20H16BrN/c1-13-9-14(2)11-16(10-13)22-19-6-4-3-5-17(19)18-12-15(21)7-8-20(18)22/h3-12H,1-2H3
InChIKey
RSNROIVDIAMOTI-UHFFFAOYSA-N
Synonyms
3-Bromo-9-(3,5-dimethylphenyl)-9H-carbazole
RefChem:499152
834-501-8
3-bromo-9-(3,5-dimethylphenyl)carbazole
MFCD31618115
Computed Properties
Structural Parameters
Heavy atom count
22
Aromatic heavy atom count
19
Fraction Csp3
0.1
Rotatable bonds
1
H-bond acceptors
1
Molar refractivity
97.96
TPSA
4.93
LogP / Solubility
WLOGP
6.16
MLOGP
5.44
XLogP3
6.4
Consensus LogP
6
Log S (ESOL)
-6.47
Class (ESOL)
Insoluble
Log S (Ali)
-6.88
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.17
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-0.48
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3
Safety & Transport
Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement Codes
P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364
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