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CAS 60397-77-5 N-(2,4-DIMETHYLPHENYL)FORMAMIDE molecular structure lightbox
CAS RN: 60397-77-5

N-(2,4-DIMETHYLPHENYL)FORMAMIDE

Product Availability

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3 package records2 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260325 1g In stock Shanghai, Shandong Inquiry
Batchno.20260506 25g Out of stock 8-10 business days Inquiry
Batchno.20260531 5g In stock Shanghai Inquiry
  • Product code: starshine_CAS60397-77-5
  • Purity/Analytical Methods: >99.0%
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60397-77-5 / N-(2,4-dimethylphenyl)formamide

Standard CAS: 60397-77-5 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
60397-77-5
Multi CAS
Yes
Molecular Formula
C9H11NO
Molecular Weight
149.190000
Exact Mass
149.084064
InChI
InChI=1S/C9H11NO/c1-7-3-4-9(10-6-11)8(2)5-7/h3-6H,1-2H3,(H,10,11)
InChIKey
JOFDPSBOUCXJCC-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.22
Rotatable bonds
2
H-bond acceptors
1
H-bond donors
1
Molar refractivity
45.6
TPSA
29.1

LogP / Solubility

WLOGP
1.87
MLOGP
1.64
XLogP3
1.5
Consensus LogP
1.67
Log S (ESOL)
-2.22
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.13
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.42
Class (SILICOS-IT)
Moderately 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)
-2.3

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

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