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CAS 146368-13-0 Sulfo-Cyanine 3 Carboxylic Acid molecular structure lightbox
CAS RN: 146368-13-0

Sulfo-Cyanine 3 Carboxylic Acid

Product Availability

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12 package records11 with current stock4 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251209 10mg In stock Inquiry
Batchno.20260421 2mg In stock Inquiry
Batchno.20260131 5mg In stock Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251119 1ml Out of stock 8-10 business days Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250717 5mg / 25mg / 100mg / 500mg Confirm by inquiry Shanghai, Shandong, Guangdong, Chongqing, Hebei Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251120 100mg In stock Shanghai Inquiry
Batchno.20260328 10mg In stock Shanghai Inquiry
Batchno.20250303 1mg In stock Shanghai Inquiry
Batchno.20260318 250mg In stock Shanghai Inquiry
Batchno.20260224 25mg In stock Shanghai Inquiry
Batchno.20250111 50mg In stock Shanghai Inquiry
Batchno.20250509 5mg In stock Shanghai Inquiry
  • Product code: SSC-057426
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 0.25g
  • Available purity: ＞97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 146368-13-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ＞97% 0 Out of Stock Shenzhen Inquiry

146368-13-0 / 2-[3-[1-(5-carboxypentyl)-3,3-dimethyl-5-sulfoindol-1-ium-2-yl]prop-2-enylidene]-1-ethyl-3,3-dimethylindole-5-sulfonate

Standard CAS: 146368-13-0 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
146368-13-0
Multi CAS
No
Molecular Formula
C31H38N2O8S2
Molecular Weight
630.800000
Exact Mass
630.206959
SMILES
CCN1C2=C(C=C(C=C2)S(=O)(=O)[O-])C(C1=CC=CC3=[N+](C4=C(C3(C)C)C=C(C=C4)S(=O)(=O)O)CCCCCC(=O)O)(C)C
InChI
InChI=1S/C31H38N2O8S2/c1-6-32-25-16-14-21(42(36,37)38)19-23(25)30(2,3)27(32)11-10-12-28-31(4,5)24-20-22(43(39,40)41)15-17-26(24)33(28)18-9-7-8-13-29(34)35/h10-12,14-17,19-20H,6-9,13,18H2,1-5H3,(H2-,34,35,36,37,38,39,40,41)
InChIKey
YDNYBBRGPORVRT-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
43
Aromatic heavy atom count
12
Fraction Csp3
0.42
Rotatable bonds
11
H-bond acceptors
7
H-bond donors
2
Molar refractivity
162.85
TPSA
155.12

LogP / Solubility

WLOGP
5.12
MLOGP
4.55
XLogP3
3.9
Consensus LogP
4.52
Log S (ESOL)
-6.45
Class (ESOL)
Insoluble
Log S (Ali)
-8.43
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-9.33
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.94

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
PAINS alerts
1
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
4.5

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