CAS RN: 322647-27-8

DLPG L-5112

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3 package records1 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251228 25mg / 100mg Out of stock 8-10 business days Inquiry
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Batchno.20250609 100mg Out of stock Inquiry
Batchno.20250824 25mg In stock Shanghai Inquiry
  • Product code: starshine_CAS322647-27-8
  • Purity/Analytical Methods: >99.0%
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322647-27-8 / sodium [(2R)-2,3-di(dodecanoyloxy)propyl] 2,3-dihydroxypropyl phosphate

Standard CAS: 322647-27-8 Multi CAS: Yes

Basic Information

CAS
322647-27-8
Multi CAS
Yes
Molecular Formula
C30H58NAO10P
Molecular Weight
632.700000
Exact Mass
632.366529
InChI
InChI=1S/C30H59O10P.Na/c1-3-5-7-9-11-13-15-17-19-21-29(33)37-25-28(26-39-41(35,36)38-24-27(32)23-31)40-30(34)22-20-18-16-14-12-10-8-6-4-2;/h27-28,31-32H,3-26H2,1-2H3,(H,35,36);/q;+1/p-1/t27?,28-;/m1./s1
InChIKey
CIRSYGHBBDDURM-AMRYRHMLSA-M

Computed Properties

Structural Parameters

Heavy atom count
42
Fraction Csp3
0.93
Rotatable bonds
30
H-bond acceptors
10
H-bond donors
2
Molar refractivity
157.13
TPSA
151.65

LogP / Solubility

WLOGP
3.14
MLOGP
2.82
XLogP3
3.14
Consensus LogP
3.03
Log S (ESOL)
-3.76
Class (ESOL)
Poorly soluble
Log S (Ali)
-7.02
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-9.98
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-4.35

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
5.5

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