CAS RN: 1179235-39-2
1-(3-methoxypropyl)-1H-pyrazol-3-amine
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250401 | 100mg / 250mg / 1g | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS1179235-39-2
- Purity/Analytical Methods: >99.0%
1179235-39-2 / 1-(3-methoxypropyl)pyrazol-3-amine
1-(3-methoxypropyl)-1H-pyrazol-3-amine | 1-(3-methoxypropyl)pyrazol-3-amine | MFCD12768275
Basic Information
CAS
1179235-39-2
Multi CAS
No
Molecular Formula
C7H13N3O
Molecular Weight
155.200000
Exact Mass
155.105862
SMILES
COCCCN1C=CC(=N1)N
InChI
InChI=1S/C7H13N3O/c1-11-6-2-4-10-5-3-7(8)9-10/h3,5H,2,4,6H2,1H3,(H2,8,9)
InChIKey
AVBOUKLCSSMLNV-UHFFFAOYSA-N
Synonyms
1-(3-methoxypropyl)-1H-pyrazol-3-amine
1-(3-methoxypropyl)pyrazol-3-amine
MFCD12768275
SCHEMBL15150212
EXB23539
Computed Properties
Structural Parameters
Heavy atom count
11
Aromatic heavy atom count
5
Fraction Csp3
0.57
Rotatable bonds
4
H-bond acceptors
4
H-bond donors
1
Molar refractivity
43.13
TPSA
53.07
LogP / Solubility
WLOGP
0.5
MLOGP
0.44
Consensus LogP
0.31
Log S (ESOL)
-1.19
Class (ESOL)
Soluble
Log S (Ali)
-1.19
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.57
Class (SILICOS-IT)
Soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.31
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
-
(3-bromo-4-fluorophenyl)methanesulfonyl chloride
- CAS RN: 1179247-63-2
- Product Code: SSC-017751
-
[1,1′-Biphenyl]-2-carboxylic acid, 4′-chloro-5-fluoro-
- CAS RN: 1179253-24-7
- Product Code: starshine_CAS1179253-24-7
- Purity/Analytical method: >99.0%
-
2-chloro-N-[1-(2-methoxyphenyl)ethyl]-N-methylacetamide
- CAS RN: 1179271-04-5
- Product Code: starshine_CAS1179271-04-5
- Purity/Analytical method: >99.0%
-
-
(R)-8-(2-amino-1-hydroxyethyl)-5-hydroxy-2H-benzo[b][1,4]oxazin-3(4H)-one
- CAS RN: 1179336-43-6
- Product Code: SSC-017757
-
2-benzhydryl-5-oxa-2,8-diazaspiro[3.5]nonan-7-one
- CAS RN: 1179337-02-0
- Product Code: SSC-017758
![CAS 1179253-24-7 [1,1′-Biphenyl]-2-carboxylic acid, 4′-chloro-5-fluoro- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1179253-24-7.gif)
![CAS 1179271-04-5 2-chloro-N-[1-(2-methoxyphenyl)ethyl]-N-methylacetamide molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1179271-04-5.gif)
![CAS 1179336-43-6 (R)-8-(2-amino-1-hydroxyethyl)-5-hydroxy-2H-benzo[b][1,4]oxazin-3(4H)-one molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1179336-43-6.gif)
![CAS 1179337-02-0 2-benzhydryl-5-oxa-2,8-diazaspiro[3.5]nonan-7-one molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1179337-02-0.gif)