CAS RN: 4840-75-9

TRIS(DIMETHYLAMINO)PHENYLSILANE

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  • Product code: starshine_CAS4840-75-9
  • Purity/Analytical Methods: >99.0%
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4840-75-9 / N-[bis(dimethylamino)-phenylsilyl]-N-methylmethanamine

Standard CAS: 4840-75-9 Multi CAS: Yes

Basic Information

CAS
4840-75-9
Multi CAS
Yes
Molecular Formula
C12H23N3Si
Molecular Weight
237.420000
Exact Mass
237.166124
InChI
InChI=1S/C12H23N3Si/c1-13(2)16(14(3)4,15(5)6)12-10-8-7-9-11-12/h7-11H,1-6H3
InChIKey
VJDVRUZAQRISHN-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
16
Aromatic heavy atom count
6
Fraction Csp3
0.5
Rotatable bonds
4
H-bond acceptors
3
Molar refractivity
72.89
TPSA
9.72

LogP / Solubility

WLOGP
0.52
MLOGP
0.46
XLogP3
0.52
Consensus LogP
0.5
Log S (ESOL)
-1.65
Class (ESOL)
Soluble
Log S (Ali)
-1.88
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.11
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)
-3.8

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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