(S) -CPW 399

CAT: 0024-sc-203690Size: 10 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0024-sc-203690Size:10 mg

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

389888-02-2

Chemical Information

(S)-2-Amino-3-(1,3,5,7-Pentahydro-2,4-Dioxo-Cyclopenta(E)Pyrimidin-1-Yl) Proionic Acid

CAS Number	389888-02-2
PubChem CID	657004
IUPAC Name	(2S)-2-amino-3-(2,4-dioxo-6,7-dihydro-5H-cyclopenta[d]pyrimidin-1-yl)propanoic acid
Molecular Formula	C10H13N3O4
Molecular Weight	239.23
XLogP	-3.7
Topological Polar Surface Area	113
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	3
Heavy Atom Count	17
Formal Charge	0
Complexity	429

SMILES

C1CC2=C(C1)N(C(=O)NC2=O)C[C@@H](C(=O)O)N

InChI

InChI=1S/C10H13N3O4/c11-6(9(15)16)4-13-7-3-1-2-5(7)8(14)12-10(13)17/h6H,1-4,11H2,(H,15,16)(H,12,14,17)/t6-/m0/s1

InChIKey

VSGUEKZRMJVQOH-LURJTMIESA-N

Chemical Structure

2D Structure

CAS: 389888-02-2

CID: 657004

Formula: C10H13N3O4

MW: 239.23

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	239.23
XLogP3	-3.7
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	3
Exact Mass	239.09060590
Monoisotopic Mass	239.09060590
Topological Polar Surface Area	113 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	429
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-215832	(S, R, S, S) -Orlistat
sc-258097	(S, S, S) -DiazaPhos-PPE
sc-250918A	(S, S) -Jacobsen's catalyst
sc-487380	(S, S, S) -Triglycidyl Isocyanurate
sc-250918	(S, S) -Jacobsen's catalyst
sc-471831	(S, S) -Oxaliplatin
sc-253457	(S, S) - (-) -Hydrobenzoin
sc-250916	(S, S) -DIPAMP
sc-477698	(R, S, S, S) -Nebivolol Hydrochloride
sc-229148	RuCl2[ (S) - (DM-BINAP) ][ (S, S) -DPEN]

Catalog	Name
B6781-10	(S)-CPW 399
GTR19242258-01	CPW-86-363
HY-103231	(S) -CPW 399
465591-01	S-CPW 399 discontinued
TRC-B781435-100MG	N-tert-Butyloxycarbonyl (S)-CPW 399