CAS RN: 946128-88-7
RO5126766(CH5126766)
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Inquiry |
|---|---|---|---|
| Batchno.20260614 | 1ml | In stock | Inquiry |
- Product code: SSC-209746
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: ≥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 |
|---|---|---|---|---|
| 0.25g | ≥95% | 0 Out of Stock | Shenzhen | Inquiry |
946128-88-7 / 3-[[3-fluoro-2-(methylsulfamoylamino)-4-pyridinyl]methyl]-4-methyl-7-pyrimidin-2-yloxychromen-2-one
Basic Information
CAS
946128-88-7
Multi CAS
No
Molecular Formula
C21FH18N5O5S
Molecular Weight
471.500000
Exact Mass
471.101268
InChI
InChI=1S/C21H18FN5O5S/c1-12-15-5-4-14(31-21-25-7-3-8-26-21)11-17(15)32-20(28)16(12)10-13-6-9-24-19(18(13)22)27-33(29,30)23-2/h3-9,11,23H,10H2,1-2H3,(H,24,27)
InChIKey
LMMJFBMMJUMSJS-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
33
Aromatic heavy atom count
22
Fraction Csp3
0.14
Rotatable bonds
7
H-bond acceptors
8
H-bond donors
2
Molar refractivity
117.93
TPSA
136.31
LogP / Solubility
WLOGP
2.68
MLOGP
2.4
XLogP3
2
Consensus LogP
2.36
Log S (ESOL)
-4.49
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.36
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.79
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-3.69
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
No
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3
Customers Also Viewed
-
4-PYRIDINECARBOXALDEHYDE, 2-CHLORO-5-NITRO-
- CAS RN: 946136-72-7
- Product Code: starshine_CAS946136-72-7
- Purity/Analytical method: >99.0%
-
SHP-141
- CAS RN: 946150-57-8
- Product Code: starshine_CAS946150-57-8
- Purity/Analytical method: >99.0%
-
3-(tert-Butoxycarbonylamino)cyclobutanecarboxylic acid
- CAS RN: 946152-72-3
- Product Code: SSC-209752
-
(1R,3R)-3-Hydroxycyclopentane carboxylic acid benzyl ester
- CAS RN: 946152-80-3
- Product Code: starshine_CAS946152-80-3
- Purity/Analytical method: >99.0%
-
2-(6-methoxypyridazin-3-yl)quinoline
- CAS RN: 946155-88-0
- Product Code: starshine_CAS946155-88-0
- Purity/Analytical method: >99.0%
-
6-piperazin-1-ylimidazo[1,2-b]pyridazine hydrochloride
- CAS RN: 946157-08-0
- Product Code: starshine_CAS946157-08-0
- Purity/Analytical method: >99.0%
![CAS 946157-08-0 6-piperazin-1-ylimidazo[1,2-b]pyridazine hydrochloride molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/946157-08-0.gif)