CAS RN: 90914-35-5
5-AMINO-3-(METHYLTHIO)-1H-PYRAZOLE-4-CARBOXAMIDE
- Product code: SSC-203623
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: 25g, 5g, 0.1g, 0.25g, 1g, 10g
- Available purity: >97%
- Inventory rows with stock: 6
- 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 |
|---|---|---|---|---|
| 25g | >97% | 5 In Stock | Shanghai | Inquiry |
| 5g | >97% | 4 In Stock | Shanghai | Inquiry |
| 0.1g | >97% | 1 In Stock | Shenzhen | Inquiry |
| 0.25g | >97% | 1 In Stock | Shenzhen | Inquiry |
| 1g | >97% | 1 In Stock | Shenzhen | Inquiry |
| 10g | >97% | 1 In Stock | Hong Kong | Inquiry |
90914-35-5 / 5-amino-3-methylsulfanyl-1H-pyrazole-4-carboxamide
Basic Information
CAS
90914-35-5
Multi CAS
Yes
Molecular Formula
C5H8N4OS
Molecular Weight
172.210000
Exact Mass
172.041882
InChI
InChI=1S/C5H8N4OS/c1-11-5-2(4(7)10)3(6)8-9-5/h1H3,(H2,7,10)(H3,6,8,9)
InChIKey
MBHLPIXKNRKHEE-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Aromatic heavy atom count
5
Fraction Csp3
0.2
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
3
Molar refractivity
43.3
TPSA
97.79
LogP / Solubility
WLOGP
-0.19
MLOGP
-0.17
XLogP3
0.1
Consensus LogP
-0.09
Log S (ESOL)
-0.99
Class (ESOL)
Very soluble
Log S (Ali)
-0.84
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.86
Class (SILICOS-IT)
Very soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.9
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
![CAS 90914-41-3 3-BROMO-4-CHLORO-1H-PYRAZOLO[3,4-D]PYRIMIDINE molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
3-BROMO-4-CHLORO-1H-PYRAZOLO[3,4-D]PYRIMIDINE
- CAS RN: 90914-41-3
- Product Code: SSC-203624
-
1H-Benzimidazole-5-carboxylicacid,1,2-dimethyl-(9CI)
- CAS RN: 90915-18-7
- Product Code: SSC-203627
-
4(1H)-Quinazolinone, 8-methoxy-2-methyl- (9CI)
- CAS RN: 90915-45-0
- Product Code: SSC-203628
-
-
-
4-Oxochromane-7-carboxylic acid
- CAS RN: 90921-09-8
- Product Code: starshine_CAS90921-09-8
- Purity/Analytical method: >99.0%
![CAS 90914-41-3 3-BROMO-4-CHLORO-1H-PYRAZOLO[3,4-D]PYRIMIDINE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/90914-41-3.gif)
