[email protected]
CAS 77924-05-1 N,N-DIISOPROPYLISONICOTINAMIDE molecular structure lightbox
CAS RN: 77924-05-1

N,N-DIISOPROPYLISONICOTINAMIDE

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250823 100mg / 250mg / 1g Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS77924-05-1
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

77924-05-1 / N,N-di(propan-2-yl)pyridine-4-carboxamide

Standard CAS: 77924-05-1 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
77924-05-1
Multi CAS
Yes
Molecular Formula
C12H18N2O
Molecular Weight
206.280000
Exact Mass
206.141913
InChI
InChI=1S/C12H18N2O/c1-9(2)14(10(3)4)12(15)11-5-7-13-8-6-11/h5-10H,1-4H3
InChIKey
HLRSGDOBQLTYNO-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
15
Aromatic heavy atom count
6
Fraction Csp3
0.5
Rotatable bonds
3
H-bond acceptors
2
Molar refractivity
60.68
TPSA
33.2

LogP / Solubility

WLOGP
2.34
MLOGP
2.06
XLogP3
1.9
Consensus LogP
2.1
Log S (ESOL)
-2.69
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.94
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.3
Class (SILICOS-IT)
Poorly 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)
-2.32

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