Verified Factory Data
Supply Overview & Packaging Options
Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.
- Pack sizes on record: 1g, 0.1g, 0.25g, 5g, 10g, 25g
- Available purity: ≥98%
- Inventory rows with stock: 3
- Bulk packaging: confirmed by inquiry
Available Pack Sizes & Stock
Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | ≥98% | 3 In Stock | Beijing | Inquiry |
| 0.1g | ≥98% | 2 In Stock | Shenzhen | Inquiry |
| 0.25g | ≥98% | 1 In Stock | Shanghai | Inquiry |
| 5g | ≥98% | 0 Out of Stock | Shanghai | Inquiry |
| 10g | ≥98% | 0 Out of Stock | Shenzhen | Inquiry |
| 25g | ≥98% | 0 Out of Stock | Shenzhen | Inquiry |
701910-14-7 / 7-bromo-2-methylindazole
Basic Information
CAS
701910-14-7
Multi CAS
No
Molecular Formula
BC8H7Rn2
Molecular Weight
211.060000
Exact Mass
209.979260
InChI
InChI=1S/C8H7BrN2/c1-11-5-6-3-2-4-7(9)8(6)10-11/h2-5H,1H3
InChIKey
KPAYIFGPJOYWMM-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Aromatic heavy atom count
9
Fraction Csp3
0.12
H-bond acceptors
2
Molar refractivity
48.41
TPSA
17.82
LogP / Solubility
WLOGP
2.34
MLOGP
2.06
XLogP3
2.3
Consensus LogP
2.23
Log S (ESOL)
-3.23
Class (ESOL)
Poorly soluble
Log S (Ali)
-2.98
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.97
Class (SILICOS-IT)
Moderately 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)
-2.35
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
1H-Pyrazole-4-carboxaldehyde, 1-ethyl-3,5-dimethyl- (9CI)
- CAS RN: 701911-46-8
- Product Code: SSC-179994
-
rac-(1R,2R)-2-(2-chlorophenyl)cyclopropane-1-carboxylic acid
- CAS RN: 701914-00-3
- Product Code: SSC-179995
-
4-Nitro-1-phenyl-1H-pyrazole-3-carboxylic acid
- CAS RN: 701917-03-5
- Product Code: SSC-179996
-
rel- N-[(1R,2R)-3-(4-Chlorophenyl)-2-(3-cyanophenyl)-1-methylpropyl]-2-methyl-2-[[5-(trifluoromethyl)-2-pyridinyl]oxy]propanamide
- CAS RN: 701977-00-6
- Product Code: starshine_CAS701977-00-6
- Purity/Analytical method: >99.0%
-
Taranabant ((1R,2R)stereoisomer)
- CAS RN: 701977-08-4
- Product Code: starshine_CAS701977-08-4
- Purity/Analytical method: >99.0%
-
N-[(1S,2S)-3-(4-Chlorophenyl)-2-(3-cyanophenyl)-1-methylpropyl]-2-methyl-2-[(5-(trifluoromethyl)pyridin-2-yl)oxy]propanamide( MK 0364)
- CAS RN: 701977-09-5
- Product Code: starshine_CAS701977-09-5
- Purity/Analytical method: >99.0%
![CAS 701977-00-6 rel- N-[(1R,2R)-3-(4-Chlorophenyl)-2-(3-cyanophenyl)-1-methylpropyl]-2-methyl-2-[[5-(trifluoromethyl)-2-pyridinyl]oxy]propanamide molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/701977-00-6.gif)
![CAS 701977-09-5 N-[(1S,2S)-3-(4-Chlorophenyl)-2-(3-cyanophenyl)-1-methylpropyl]-2-methyl-2-[(5-(trifluoromethyl)pyridin-2-yl)oxy]propanamide( MK 0364) molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/701977-09-5.gif)