![CAS 1373253-21-4 4-AMino-1H-pyrrolo[2,3-b]pyridine acetate molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/CB12619971(1).gif)
CAS RN: 1373253-21-4
4-AMino-1H-pyrrolo[2,3-b]pyridine acetate
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.20260506 | 100mg / 250mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS1373253-21-4
- Purity/Analytical Methods: >99.0%
1373253-21-4 / acetic acid;1H-pyrrolo[2,3-b]pyridin-4-amine
Basic Information
CAS
1373253-21-4
Multi CAS
No
Molecular Formula
C9H11N3O2
Molecular Weight
193.200000
Exact Mass
193.085127
SMILES
CC(=O)O.C1=CNC2=NC=CC(=C21)N
InChI
InChI=1S/C7H7N3.C2H4O2/c8-6-2-4-10-7-5(6)1-3-9-7;1-2(3)4/h1-4H,(H3,8,9,10);1H3,(H,3,4)
InChIKey
DQXDMLNTPZMDBL-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
14
Aromatic heavy atom count
9
Fraction Csp3
0.11
H-bond acceptors
3
H-bond donors
3
Molar refractivity
53.82
TPSA
92
LogP / Solubility
WLOGP
1.24
MLOGP
1.09
XLogP3
1.24
Consensus LogP
1.19
Log S (ESOL)
-2.29
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.04
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-1.94
Class (SILICOS-IT)
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)
-3.02
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 1373253-24-7 2-BroMoiMidazo[2,1-b][1,3,4]thiadiazole-6-carboxylic acid molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
2-BroMoiMidazo[2,1-b][1,3,4]thiadiazole-6-carboxylic acid
- CAS RN: 1373253-24-7
- Product Code: SSC-046822
-
-
1-Benzhydryl-3-aMinoazetidine Mesylate
- CAS RN: 1373253-26-9
- Product Code: starshine_CAS1373253-26-9
- Purity/Analytical method: >99.0%
-
3-(3-Nitrophenoxy)azetidine hydrochloride
- CAS RN: 1373253-27-0
- Product Code: starshine_CAS1373253-27-0
- Purity/Analytical method: >99.0%
-
4-Oxopiperidine-3-carbonitrile hydrochloride
- CAS RN: 1373253-28-1
- Product Code: SSC-046824
-
USL-311
- CAS RN: 1373268-67-7
- Product Code: starshine_CAS1373268-67-7
- Purity/Analytical method: >99.0%
![CAS 1373253-24-7 2-BroMoiMidazo[2,1-b][1,3,4]thiadiazole-6-carboxylic acid molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1373253-24-7.gif)
