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CAS 7361-07-1 GUANOSINE 5′-MONOPHOSPHOMORPHOLIDATE 4-MORPHOLINE-N,N’-DICYCLOHEXYLCARBOXAMIDINE SALT molecular structure lightbox
CAS RN: 7361-07-1

GUANOSINE 5′-MONOPHOSPHOMORPHOLIDATE 4-MORPHOLINE-N,N’-DICYCLOHEXYLCARBOXAMIDINE SALT

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250409 25mg Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS7361-07-1
  • Purity/Analytical Methods: >99.0%
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7361-07-1 / [(2R,3S,4R,5R)-5-(2-amino-6-oxo-1H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-morpholin-4-ylphosphinic acid;N,N'-dicyclohexylmorpholine-4-carboximidamide

Standard CAS: 7361-07-1 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
7361-07-1
Multi CAS
Yes
Molecular Formula
C31H52N9O9P
Molecular Weight
725.800000
Exact Mass
725.362561
InChI
InChI=1S/C17H31N3O.C14H21N6O8P/c1-3-7-15(8-4-1)18-17(20-11-13-21-14-12-20)19-16-9-5-2-6-10-16;15-14-17-11-8(12(23)18-14)16-6-20(11)13-10(22)9(21)7(28-13)5-27-29(24,25)19-1-3-26-4-2-19/h15-16H,1-14H2,(H,18,19);6-7,9-10,13,21-22H,1-5H2,(H,24,25)(H3,15,17,18,23)/t;7-,9-,10-,13-/m.1/s1
InChIKey
CFNWUGDJWKRMBL-VAMAKUSHSA-N

Computed Properties

Structural Parameters

Heavy atom count
50
Aromatic heavy atom count
9
Fraction Csp3
0.81
Rotatable bonds
7
H-bond acceptors
13
H-bond donors
6
Molar refractivity
183.36
TPSA
235.14

LogP / Solubility

WLOGP
0.7
MLOGP
0.68
XLogP3
0.7
Consensus LogP
0.69
Log S (ESOL)
-4.45
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.02
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-5.8
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
Yes
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-6.65

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
8.5

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