[email protected]
CAS 1416374-97-4 Carbamic acid, N-pyrazolo[1,5-a]pyridin-3-yl-, 1,1-dimethylethyl ester molecular structure lightbox
CAS RN: 1416374-97-4

Carbamic acid, N-pyrazolo[1,5-a]pyridin-3-yl-, 1,1-dimethylethyl ester

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260325 100mg / 1g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS1416374-97-4
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

1416374-97-4 / tert-butyl N-pyrazolo[1,5-a]pyridin-3-ylcarbamate

Standard CAS: 1416374-97-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1416374-97-4
Multi CAS
No
Molecular Formula
C12H15N3O2
Molecular Weight
233.270000
Exact Mass
233.116427
SMILES
CC(C)(C)OC(=O)NC1=C2C=CC=CN2N=C1
InChI
InChI=1S/C12H15N3O2/c1-12(2,3)17-11(16)14-9-8-13-15-7-5-4-6-10(9)15/h4-8H,1-3H3,(H,14,16)
InChIKey
IRYLDOUKPWMKMP-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
17
Aromatic heavy atom count
9
Fraction Csp3
0.33
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
1
Molar refractivity
65.05
TPSA
55.63

LogP / Solubility

WLOGP
2.68
MLOGP
2.36
XLogP3
1.6
Consensus LogP
2.21
Log S (ESOL)
-3.3
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.41
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.52
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.24

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

Customers Also Viewed

Get In Touch

Contact Us