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CAS 345630-40-2 SF1670(PTENinhibitor) molecular structure lightbox
CAS RN: 345630-40-2

SF1670(PTENinhibitor)

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6 package records5 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260225 100mg Out of stock Inquiry
Batchno.20250506 10mg In stock Shanghai, Wuhan Inquiry
Batchno.20251126 1mg In stock Shanghai, Tianjin, Wuhan Inquiry
Batchno.20250216 25mg In stock Shanghai, Wuhan Inquiry
Batchno.20260320 50mg In stock Shanghai Inquiry
Batchno.20250805 5mg In stock Shanghai, Wuhan Inquiry
  • Product code: starshine_CAS345630-40-2
  • Purity/Analytical Methods: >99.0%
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345630-40-2 / N-(9,10-dioxophenanthren-2-yl)-2,2-dimethylpropanamide

Standard CAS: 345630-40-2 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
345630-40-2
Multi CAS
No
Molecular Formula
C19H17NO3
Molecular Weight
307.300000
Exact Mass
307.120843
InChI
InChI=1S/C19H17NO3/c1-19(2,3)18(23)20-11-8-9-13-12-6-4-5-7-14(12)16(21)17(22)15(13)10-11/h4-10H,1-3H3,(H,20,23)
InChIKey
VZQDDSYKVYARDW-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
23
Aromatic heavy atom count
12
Fraction Csp3
0.21
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
88.62
TPSA
63.24

LogP / Solubility

WLOGP
3.72
MLOGP
3.28
XLogP3
3.1
Consensus LogP
3.37
Log S (ESOL)
-4.41
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.76
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.86
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.96

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
PAINS alerts
1
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5

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