![CAS 1020172-07-9 N-[3-tert-Butyl-1-(quinolin-6-yl)-1H-pyrazol-5-yl]-N’-[2-fluoro-4-[(2-(methylcarbamoyl)pyridin-4-yl)oxy]phenyl]urea molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1020172-07-9.gif)
CAS RN: 1020172-07-9
N-[3-tert-Butyl-1-(quinolin-6-yl)-1H-pyrazol-5-yl]-N’-[2-fluoro-4-[(2-(methylcarbamoyl)pyridin-4-yl)oxy]phenyl]urea
Product Availability
Choose a grade to view its available package options.
9 package records5 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20251225 | 100mg | In stock | Shanghai | Inquiry | |
| Batchno.20260509 | 10mg | Out of stock | Inquiry | ||
| Batchno.20260630 | 1g | Out of stock | Inquiry | ||
| Batchno.20251009 | 250mg | Out of stock | Inquiry | ||
| Batchno.20260325 | 50mg | In stock | Shanghai, Tianjin | Inquiry | |
| Batchno.20250712 | 5mg / 10mg / 50mg | Out of stock | 15 business days | Inquiry |
- Product code: SSC-003247
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: 0.25g
- Available purity: ＞97%
- 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 |
|---|---|---|---|---|
| 0.25g | ＞97% | 0 Out of Stock | Hong Kong | Inquiry |
1020172-07-9 / 4-[4-[(3-tert-butyl-1-quinolin-6-ylpyrazol-5-yl)carbamoylamino]-3-fluorophenoxy]-N-methylpyridine-2-carboxamide
REBASTINIB | DCC-2036 | DCC 2036
Basic Information
CAS
1020172-07-9
Multi CAS
No
Molecular Formula
C30H28FN7O3
Molecular Weight
553.600000
Exact Mass
553.223766
SMILES
CC(C)(C)C1=NN(C(=C1)NC(=O)NC2=C(C=C(C=C2)OC3=CC(=NC=C3)C(=O)NC)F)C4=CC5=C(C=C4)N=CC=C5
InChI
InChI=1S/C30H28FN7O3/c1-30(2,3)26-17-27(38(37-26)19-7-9-23-18(14-19)6-5-12-33-23)36-29(40)35-24-10-8-20(15-22(24)31)41-21-11-13-34-25(16-21)28(39)32-4/h5-17H,1-4H3,(H,32,39)(H2,35,36,40)
InChIKey
WVXNSAVVKYZVOE-UHFFFAOYSA-N
Synonyms
REBASTINIB
DCC-2036
DCC 2036
DP-1919
DCC-2036 FREE BASE
Computed Properties
Structural Parameters
Heavy atom count
41
Aromatic heavy atom count
27
Fraction Csp3
0.17
Rotatable bonds
6
H-bond acceptors
7
H-bond donors
3
Molar refractivity
154.31
TPSA
123.06
LogP / Solubility
WLOGP
6.05
MLOGP
5.36
XLogP3
4.9
Consensus LogP
5.44
Log S (ESOL)
-7.17
Class (ESOL)
Insoluble
Log S (Ali)
-8.47
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-9
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
Yes
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.8
Drug-likeness / Medicinal Chemistry
Lipinski
No
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.17
Leadlikeness
No
Synthetic Accessibility
5
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