Research chemical
CAS Number: 2148-32-5
![(2S)-2-amino-4-{[(1R)-1-[(carboxymethyl)carbamoyl]-2-{[(1E)-1,2-dichloroethenyl]sulfanyl}ethyl]carbamoyl}butanoic acid molecular structure, CAS 2148-32-5](/structure-images/2148-32-5.png?v=struct-v3)
Product details
For laboratory research and professional procurement workflows.
PubChem CID
53939867
Exact Mass
401.021512
InChIKey
IXARYIJEQUJTIZ-UHFFFAOYSA-N
IUPAC Name
2-amino-5-[[1-(carboxymethylamino)-3-(1,2-dichloroethenylsulfanyl)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
SMILES String
NC(CCC(=O)NC(CSC(Cl)=CCl)C(=O)NCC(=O)O)C(=O)O
No physical property values available.
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Catalog navigation
Linked by recorded structural or research relationships, not interchangeable products. Check the exact CAS, specification and availability on the linked product page.
(2S)-2-amino-4-{[(1R)-1-[(carboxymethyl)carbamoyl]-2-{[(1E)-1,2-dichloroethenyl]sulfanyl}ethyl]carbamoyl}butanoic acid is identified by CAS 2148-32-5, with molecular formula C12H17Cl2N3O6S, molecular weight 402.3, InChIKey IXARYIJEQUJTIZ-UHFFFAOYSA-N.
Yes. Submit an RFQ and specify COA requirements. Lot-specific COA depends on supplier confirmation.
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Heavy atom count
24
H-bond acceptors
9
H-bond donors
6
Rotatable bonds
11
Ring count
0
Aromatic rings
0
Topological polar surface area
158.82 Ų
Computed LogP
-0.13
Fragment-like structure rule
No
Lead-like structure rule
No
Drug-like structure rule
No
Structure family
organic nitrogen ligand candidate
Precious metal motif
No
Transition metal motif
No
Phosphine ligand motif
No
N-heterocycle motif
No
Boronic acid motif
No
Computed structure descriptors generated from molecular structure. These are not experimental physical property values, supplier specifications, SDS data, or bioactivity claims.
Structural features
(2S)-2-amino-4-{[(1R)-1-[(carboxymethyl)carbamoyl]-2-{[(1E)-1,2-dichloroethenyl]sulfanyl}ethyl]carbamoyl}butanoic acid (CAS 2148-32-5) is maintained as a commercial cas reference with formula C12H17Cl2N3O6S, molecular weight 402.
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
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Documentation needs
Review supplier documentation before handling; for research use only.
Safety and handling reference content is available through documentation requests.
For supplier-issued SDS, request documentation before handling, storage, shipment, or procurement decisions.