Phenyl N-cyano-N'-(2-{[4-(2,4-difluorophenyl)-8-(2-fluorophenyl)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-2-yl]amino}ethyl)imidocarbamate (HCID 59789332)

기본 정보

표준 SMILES: N#CNC(=NCCNc1nc(-c2ccc(F)cc2F)c2ccc(=O)n(-c3ccccc3F)c2n1)Oc1ccccc1
InChIKey: IKAFQJXVTVWKHQ-UHFFFAOYSA-N
분자식: C29H20F3N7O2
평균 분자량: 555.5 g/mol

이름 및 식별자

우선 이름: Phenyl N-cyano-N'-(2-{[4-(2,4-difluorophenyl)-8-(2-fluorophenyl)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-2-yl]amino}ethyl)imidocarbamate
IUPAC: phenyl N-cyano-N'-[2-[[4-(2,4-difluorophenyl)-8-(2-fluorophenyl)-7-oxopyrido[2,3-d]pyrimidin-2-yl]amino]ethyl]carbamimidate

이름 및 동의어

SCHEMBL4180082SCHEMBL4180083SCHEMBL13853011IKAFQJXVTVWKHQ-UHFFFAOYSA-Nphenyl N-cyano-N'-(2-{[4-(2,4-difluorophenyl)-8-(2-fluorophenyl)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-2-yl]amino}-ethyl)imidocarbamatePhenyl N-cyano-N'-(2-{[4-(2,4-difluorophenyl)-8-(2-fluorophenyl)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-2-yl]amino}ethyl)imidocarbamate

데이터베이스 식별자

PubChem CID: 59789332

물성

구조 계산 물성

XLogP: 5.4
극성 표면적: 116 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 10
회전 가능 결합 수: 9
무거운 원자 수: 41
형식 전하: 0
복잡도: 1,000

화합물 노트

불러오는 중…