![CAS 1228551-77-6 Tetrazolo[1,5-a]pyridin-7-amine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/CB42688693.gif)
CAS RN: 1228551-77-6
Tetrazolo[1,5-a]pyridin-7-amine
Product Availability
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3 package records0 with current stock1 grade group
- Product code: starshine_CAS1228551-77-6
- Purity/Analytical Methods: >99.0%
1228551-77-6 / tetrazolo[1,5-a]pyridin-7-amine
Basic Information
CAS
1228551-77-6
Multi CAS
No
Molecular Formula
C5H5N5
Molecular Weight
135.130000
Exact Mass
135.054495
SMILES
C1=CN2C(=NN=N2)C=C1N
InChI
InChI=1S/C5H5N5/c6-4-1-2-10-5(3-4)7-8-9-10/h1-3H,6H2
InChIKey
QHWJGMVBUNNSAU-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
10
Aromatic heavy atom count
9
H-bond acceptors
5
H-bond donors
1
Molar refractivity
35.19
TPSA
69.1
LogP / Solubility
WLOGP
-0.29
MLOGP
-0.27
XLogP3
-0.8
Consensus LogP
-0.45
Log S (ESOL)
-1.16
Class (ESOL)
Soluble
Log S (Ali)
-0.46
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.29
Class (SILICOS-IT)
Very 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)
-3.75
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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![CAS 1228551-91-4 4-[-((-((4-(5-(Bis(2-hydroxyethyl)aMino)-1-Methyl-1H-benzo[d]iMidazol-2-yl)butanoyl)oxy)ethyl)(2-hydroxyethyl)aMino)-1-Methyl-1H-benzo[d]iMidazol-2-yl)butanic Acid molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1228551-91-4.gif)
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