CAS RN: 371934-59-7

PIK-inhibitors

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Batchno.20250909 5mg Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS371934-59-7
  • Purity/Analytical Methods: >99.0%
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371934-59-7 / 3-(6-morpholin-4-yl-8-oxa-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-4-yl)aniline

Standard CAS: 371934-59-7 Multi CAS: No

Basic Information

CAS
371934-59-7
Multi CAS
No
Molecular Formula
C19H17N5O2
Molecular Weight
347.400000
Exact Mass
347.138225
InChI
InChI=1S/C19H17N5O2/c20-13-4-1-3-12(11-13)17-22-15-14-5-2-6-21-19(14)26-16(15)18(23-17)24-7-9-25-10-8-24/h1-6,11H,7-10,20H2
InChIKey
RQPKSOWRJPRYCN-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
26
Aromatic heavy atom count
19
Fraction Csp3
0.21
Rotatable bonds
2
H-bond acceptors
7
H-bond donors
1
Molar refractivity
99.99
TPSA
90.3

LogP / Solubility

WLOGP
2.86
MLOGP
2.53
XLogP3
2.4
Consensus LogP
2.6
Log S (ESOL)
-4.2
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.47
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.53
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.81

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
3.5

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