![CAS 1015460-62-4 9-Bromo-5H-pyrido[4,3-b]indole molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1015460-62-4.gif)
CAS RN: 1015460-62-4
9-Bromo-5H-pyrido[4,3-b]indole
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.20251014 | 100mg / 250mg / 1g | Out of stock | 5-7 business days | Inquiry |
- Product code: SSC-002366
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 | Shanghai | Inquiry |
1015460-62-4 / 9-bromo-5H-pyrido[4,3-b]indole
9-bromo-5H-pyrido[4,3-b]indole | MFCD30181901 | SCHEMBL31677485
Basic Information
CAS
1015460-62-4
Multi CAS
No
Molecular Formula
C11H7BrN2
Molecular Weight
247.090000
Exact Mass
245.979260
SMILES
C1=CC2=C(C(=C1)Br)C3=C(N2)C=CN=C3
InChI
InChI=1S/C11H7BrN2/c12-8-2-1-3-10-11(8)7-6-13-5-4-9(7)14-10/h1-6,14H
InChIKey
AQVVGJGWWRZZKM-UHFFFAOYSA-N
Synonyms
9-bromo-5H-pyrido[4,3-b]indole
MFCD30181901
SCHEMBL31677485
AKOS030632885
SB30121
Computed Properties
Structural Parameters
Heavy atom count
14
Aromatic heavy atom count
13
H-bond acceptors
1
H-bond donors
1
Molar refractivity
61.3
TPSA
28.68
LogP / Solubility
WLOGP
3.48
MLOGP
3.07
XLogP3
3
Consensus LogP
3.18
Log S (ESOL)
-4.25
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.1
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.15
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.76
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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