CAS RN: 83783-33-9
3-FORMYL-1H-INDOLE-6-CARBONITRILE
Product Availability
Choose a grade to view its available package options.
4 package records3 with current stock2 grade groups
- Product code: SSC-191489
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: 5g
- 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 |
|---|---|---|---|---|
| 5g | ≥95% | 0 Out of Stock | Beijing | Inquiry |
83783-33-9 / 3-formyl-1H-indole-6-carbonitrile
Basic Information
CAS
83783-33-9
Multi CAS
Yes
Molecular Formula
C10H6N2O
Molecular Weight
170.170000
Exact Mass
170.048013
InChI
InChI=1S/C10H6N2O/c11-4-7-1-2-9-8(6-13)5-12-10(9)3-7/h1-3,5-6,12H
InChIKey
KCNWLZZKKCXGOC-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
13
Aromatic heavy atom count
9
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
48.4
TPSA
56.65
LogP / Solubility
WLOGP
1.85
MLOGP
1.63
XLogP3
1.4
Consensus LogP
1.63
Log S (ESOL)
-2.51
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.29
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.42
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.44
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
-
2-AMINO-1-((4-FLUOROPHENYL)METHYL)BENZI&
- CAS RN: 83783-69-1
- Product Code: starshine_CAS83783-69-1
- Purity/Analytical method: >99.0%
-
3-[bis(benzyl)amino]hexahydro-2H-azepin-2-one
- CAS RN: 83783-77-1
- Product Code: starshine_CAS83783-77-1
- Purity/Analytical method: >99.0%
-
(2-butylbenzofuran-3-yl) (4-methoxyphenyl) ketone
- CAS RN: 83790-87-8
- Product Code: SSC-191491
-
-
VINCLOZOLIN
- CAS RN: 83792-61-4
- Product Code: starshine_CAS83792-61-4
- Purity/Analytical method: >99.0%
![CAS 83783-77-1 3-[bis(benzyl)amino]hexahydro-2H-azepin-2-one molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/83783-77-1.gif)
