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CAS 4147-51-7 DIPROPETRYN molecular structure lightbox
CAS RN: 4147-51-7

DIPROPETRYN

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4 package records3 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251104 100mg In stock Shanghai Inquiry
Batchno.20250823 1g In stock Shanghai Inquiry
Batchno.20251208 250mg In stock Shanghai Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250221 100mg Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS4147-51-7
  • Purity/Analytical Methods: >99.0%
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4147-51-7 / 6-ethylsulfanyl-2-N,4-N-di(propan-2-yl)-1,3,5-triazine-2,4-diamine

Standard CAS: 4147-51-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
4147-51-7
Multi CAS
No
Molecular Formula
C11H21N5S
Molecular Weight
255.390000
Exact Mass
255.151767
InChI
InChI=1S/C11H21N5S/c1-6-17-11-15-9(12-7(2)3)14-10(16-11)13-8(4)5/h7-8H,6H2,1-5H3,(H2,12,13,14,15,16)
InChIKey
NPWMZOGDXOFZIN-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
17
Aromatic heavy atom count
6
Fraction Csp3
0.73
Rotatable bonds
6
H-bond acceptors
6
H-bond donors
2
Molar refractivity
73.74
TPSA
62.73

LogP / Solubility

WLOGP
2.62
MLOGP
2.32
XLogP3
3.9
Consensus LogP
2.95
Log S (ESOL)
-2.94
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.55
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.22
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.41

Drug-likeness / Medicinal Chemistry

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

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