[email protected]
CAS 110351-93-4 “CHUGAI-01(4’S)-4′-ethyl-1′,4′,7′,8′-tetrahydro-4′-hydroxy-3’H,10’H-spiro[1,3-dioxolane-2,6′-pyrano[3,4-f]indolizine]-3′,10′-dione” molecular structure lightbox
CAS RN: 110351-93-4

“CHUGAI-01(4’S)-4′-ethyl-1′,4′,7′,8′-tetrahydro-4′-hydroxy-3’H,10’H-spiro[1,3-dioxolane-2,6′-pyrano[3,4-f]indolizine]-3′,10′-dione”

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251120 100mg / 250mg / 1g Out of stock 8-10 business days Inquiry
  • Product code: SSC-011447
GET A QUOTE
Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 0.1g, 0.25g, 1g, 5g
  • Available purity: ≥97%
  • Inventory rows with stock: 4
  • Bulk packaging: confirmed by inquiry
Request Bulk Quote

Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 110351-93-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g ≥97% 5 In Stock Shanghai Inquiry
0.25g ≥97% 5 In Stock Shanghai Inquiry
1g ≥97% 5 In Stock Shanghai Inquiry
5g ≥97% 1 In Stock Beijing Inquiry

110351-93-4 / (4'S)-4'-ethyl-4'-hydroxyspiro[1,3-dioxolane-2,6'-7,8-dihydro-1H-pyrano[3,4-f]indolizine]-3',10'-dione

(4'S)-4'-Ethyl-7',8'-dihydro-4'-hydroxyspiro[1,3-dioxolane-2,6'(3'H)-[1H]pyrano[3,4-f]indolizine]-3',10'(4'H)-dione | (4'S)-4'-Ethyl-7',8'-dihydro-4'-hydroxyspiro(1,3-dioxolane-2,6'(3'H)-(1H)pyrano(3,4-f)indolizine)-3',10'(4'H)-dione | RefChem:208413

Standard CAS: 110351-93-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
110351-93-4
Multi CAS
No
Molecular Formula
C15H17NO6
Molecular Weight
307.300000
Exact Mass
307.105587
SMILES
CC[C@@]1(C2=C(COC1=O)C(=O)N3CCC4(C3=C2)OCCO4)O
InChI
InChI=1S/C15H17NO6/c1-2-14(19)10-7-11-15(21-5-6-22-15)3-4-16(11)12(17)9(10)8-20-13(14)18/h7,19H,2-6,8H2,1H3/t14-/m0/s1
InChIKey
GHFZMAJAVDXFDR-AWEZNQCLSA-N
Synonyms
(4'S)-4'-Ethyl-7',8'-dihydro-4'-hydroxyspiro[1,3-dioxolane-2,6'(3'H)-[1H]pyrano[3,4-f]indolizine]-3',10'(4'H)-dione (4'S)-4'-Ethyl-7',8'-dihydro-4'-hydroxyspiro(1,3-dioxolane-2,6'(3'H)-(1H)pyrano(3,4-f)indolizine)-3',10'(4'H)-dione RefChem:208413 Exatecan intermediate 12 Spiro[1,3-dioxolane-2,6'(3'H)-[1H]pyrano[3,4-f]indolizine]-3',10'(4'H)-dione, 4'-ethyl-7',8'-dihydro-4'-hydroxy-, (4'S)-

Computed Properties

Structural Parameters

Heavy atom count
22
Aromatic heavy atom count
6
Fraction Csp3
0.6
Rotatable bonds
1
H-bond acceptors
7
H-bond donors
1
Molar refractivity
72.88
TPSA
86.99

LogP / Solubility

WLOGP
0.11
MLOGP
0.11
XLogP3
-1.2
Consensus LogP
-0.33
Log S (ESOL)
-1.95
Class (ESOL)
Soluble
Log S (Ali)
-2.16
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-1.87
Class (SILICOS-IT)
Soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.52

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
4.5

Customers Also Viewed

Get In Touch

Contact Us