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CAS 784-94-1 4-AMINO-N-METHYL-N-PHENYL-BENZAMIDE molecular structure lightbox
CAS RN: 784-94-1

4-AMINO-N-METHYL-N-PHENYL-BENZAMIDE

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250628 100mg / 1g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS784-94-1
  • Purity/Analytical Methods: >99.0%
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784-94-1 / 4-amino-N-methyl-N-phenylbenzamide

Standard CAS: 784-94-1 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
784-94-1
Multi CAS
No
Molecular Formula
C14H14N2O
Molecular Weight
226.270000
Exact Mass
226.110613
InChI
InChI=1S/C14H14N2O/c1-16(13-5-3-2-4-6-13)14(17)11-7-9-12(15)10-8-11/h2-10H,15H2,1H3
InChIKey
CRHKLAPXNLGNBS-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
17
Aromatic heavy atom count
12
Fraction Csp3
0.07
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
1
Molar refractivity
70.03
TPSA
46.33

LogP / Solubility

WLOGP
2.55
MLOGP
2.24
XLogP3
1.7
Consensus LogP
2.16
Log S (ESOL)
-3.24
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.25
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.48
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)
-2.29

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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